data_1wfs_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 1wfs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.798 0.332 . . . . 74.12 111.172 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.469 ' CG2' HG22 ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 74.42 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.5 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 75.01 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 75.34 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.33 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HD13 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 74.23 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.573 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 74.13 110.854 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.833 0.349 . . . . 65.44 110.904 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 62.44 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 75.42 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 ' CD2' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.13 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.451 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.402 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.21 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 71.41 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.571 HG13 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 71.22 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 71.13 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 73.21 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 74.42 111.109 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 72.14 111.144 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.453 ' N ' HD13 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 70.02 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.32 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.509 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 75.05 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 75.33 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 73.51 110.915 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.481 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 71.42 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.44 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.437 ' CD2' HG23 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.471 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.4 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.432 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.471 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.42 ' C ' HG22 ' A' ' 75' ' ' VAL . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.437 HG23 ' CD2' ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 75.43 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 72.33 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.12 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.23 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 65.15 111.162 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 73.42 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.14 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 74.45 110.894 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 75.4 110.906 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.46 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 74.45 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 75.22 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 72.23 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 53.23 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 71.4 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 73.33 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 73.05 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 64.55 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 72.14 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 75.22 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.499 ' N ' ' O ' ' A' ' 106' ' ' GLN . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.571 ' CE2' HG13 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.15 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 73.3 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 73.2 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.46 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 75.0 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 72.52 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.469 HG22 ' CG2' ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.492 ' O ' ' CZ ' ' A' ' 28' ' ' ARG . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 75.52 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.915 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 75.54 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 71.32 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 73.34 111.146 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.35 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 72.04 110.954 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 74.4 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 70.3 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.406 ' C ' ' N ' ' A' ' 140' ' ' LEU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.422 HD12 ' CD2' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 63.34 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HD2' ' CZ ' ' A' ' 79' ' ' TYR . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 72.42 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.869 0.366 . . . . 72.35 111.106 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.469 HG21 ' CG2' ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.24 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 74.02 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 71.21 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 51' ' ' LEU . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 74.43 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.469 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.5 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 74.12 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.55 ' CD2' HD22 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 71.23 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.511 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 74.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 71.14 110.848 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.44 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 71.13 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.515 HD12 ' CG ' ' A' ' 27' ' ' PHE . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 74.52 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.408 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 65.33 110.861 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.648 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 74.41 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 75.2 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 75.12 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.411 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.465 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 75.04 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.525 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 75.12 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 55.32 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.434 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.891 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.434 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 73.01 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.31 110.901 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 51.23 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 65.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.564 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.408 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.03 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 73.21 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.43 HG11 ' CE2' ' A' ' 27' ' ' PHE . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.24 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 62.34 111.152 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 75.33 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.52 111.113 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 71.42 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 75.5 110.882 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.55 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.558 ' CD2' HG21 ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 75.34 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 75.52 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 74.21 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.03 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 75.53 112.314 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.32 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 75.34 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.44 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.648 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 53.31 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 70.14 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 75.12 110.893 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 74.34 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.48 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.558 HG21 ' CD2' ' A' ' 94' ' ' PHE . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.469 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 73.15 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.561 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.478 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 72.52 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 72.34 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 75.24 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 74.0 110.927 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 72.22 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.466 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.478 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 70.13 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.52 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.793 0.33 . . . . 72.33 111.161 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 75.41 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 71.31 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.41 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 73.52 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.468 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CG ' HD12 ' A' ' 38' ' ' ILE . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 74.34 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.835 0.35 . . . . 65.33 110.917 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 64.04 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.449 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.513 HD12 ' CG ' ' A' ' 27' ' ' PHE . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.507 ' CG2' ' NE ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 75.01 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG22 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.63 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 73.45 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 65.31 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.419 HG13 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 52' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 71.43 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.451 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 65.3 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.504 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.544 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.493 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 64.24 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.493 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.404 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 66' ' ' GLU . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.54 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.83 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.459 ' CD2' HG23 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 74.45 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.32 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.453 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 74.44 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.556 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 63.23 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.507 ' NE ' ' CG2' ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.459 HG23 ' CD2' ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 75.21 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.439 HG22 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 74.11 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 74.5 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 83' ' ' HIS . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 74.02 111.154 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.428 ' N ' HG13 ' A' ' 82' ' ' VAL . 20.8 m-70 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.828 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 71.35 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 71.42 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.421 HG23 ' CG2' ' A' ' 82' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 71.41 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.505 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 75.45 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.564 ' CE1' HG21 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 70.55 110.892 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 60.51 112.312 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.453 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 74.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 63.42 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.63 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 75.24 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 73.22 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 73.01 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 73.41 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.847 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 64.33 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.564 HG21 ' CE1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 73.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 75.0 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG22 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.468 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 54.45 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 75.54 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 74.31 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.896 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.3 111.067 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.456 ' C ' ' O ' ' A' ' 131' ' ' THR . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.466 ' CD1' ' HB3' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 74.33 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 70.21 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 72.52 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 70.32 111.099 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.763 0.316 . . . . 73.23 111.179 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.435 ' O ' ' C ' ' A' ' 17' ' ' ASP . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 64.54 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 61.42 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 64.11 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 72.34 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 20' ' ' LEU . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 71.33 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 73.54 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 73.14 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.447 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.11 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.871 0.367 . . . . 72.31 110.855 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 63.4 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 74.33 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.512 HD12 ' CG ' ' A' ' 27' ' ' PHE . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.5 111.101 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.454 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.618 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 4.0 mm-40 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.928 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 72.15 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.429 ' N ' HD13 ' A' ' 20' ' ' LEU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.896 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.407 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.44 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 65.24 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.528 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.486 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 72.42 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 73.01 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.858 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 72.31 110.875 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.407 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 71.52 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.415 HD22 ' CG2' ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 74.42 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 71.13 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.426 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.43 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 73.41 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.562 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 63.15 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 74.23 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.415 ' CG2' HD22 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 72.32 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.454 HG23 ' CE ' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 75.44 111.133 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 110.858 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.3 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.146 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.443 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 75.51 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 71.51 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.858 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 71.4 110.862 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 72.2 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.618 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 70.04 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 61.11 112.539 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 74.42 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.23 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 71.12 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 75.0 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.434 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 72.54 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.437 ' O ' ' CB ' ' A' ' 122' ' ' GLU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.14 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.922 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 74.24 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 75.52 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 74.42 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 72.43 110.918 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 71.04 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 74.24 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 75.02 110.925 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.44 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.415 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 74.43 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.489 HD12 ' CD1' ' A' ' 79' ' ' TYR . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 75.55 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.891 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 65.22 110.924 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 74.23 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 73.32 111.099 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.78 0.324 . . . . 73.54 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.466 HG23 ' CG2' ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 74.35 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.477 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.449 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 73.41 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.448 HD13 ' CA ' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.504 ' CG ' HD13 ' A' ' 38' ' ' ILE . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 73.34 110.92 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.861 0.363 . . . . 64.22 110.87 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.42 111.085 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.504 HD13 ' CG ' ' A' ' 27' ' ' PHE . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.4 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 71.55 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 71.43 110.906 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.599 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 75.22 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.096 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 53' ' ' ASP . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 73.23 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.456 ' N ' HD23 ' A' ' 51' ' ' LEU . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 75.04 110.848 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.5 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.1 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.526 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.34 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.495 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.495 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 72.22 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 75.0 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.41 110.894 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 73.43 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 75.12 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 70.41 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 72.34 111.111 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 71.55 111.109 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 71.04 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 75.03 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 64.54 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 74.42 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 74.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.54 111.106 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 65.35 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 75.2 112.381 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.478 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 75.31 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 72.45 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.442 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.46 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.015 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 75.51 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 62.4 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 64.42 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.599 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.34 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 63.43 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 64.03 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.46 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 74.24 110.898 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.442 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 70.22 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.466 ' CG2' HG23 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.448 ' CA ' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 71.32 110.965 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.05 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.51 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 75.5 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.55 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 70.21 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 70.23 110.984 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.53 110.924 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 71.12 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.845 0.355 . . . . 75.32 111.148 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 17' ' ' ASP . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 74.51 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 75.1 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD2' HD23 ' A' ' 24' ' ' LEU . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.476 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 70.32 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.569 ' CD1' HD12 ' A' ' 38' ' ' ILE . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 75.01 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.566 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.42 110.804 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.847 0.356 . . . . 64.15 110.9 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.569 HD12 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.1 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 70.23 110.878 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.622 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 71.2 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.463 ' CA ' ' HE3' ' A' ' 109' ' ' MET . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 73.52 110.964 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 74.52 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.406 ' CG ' HG12 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.13 111.187 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.406 HG12 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 65.42 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.469 HD23 ' N ' ' A' ' 53' ' ' ASP . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.469 ' N ' HD23 ' A' ' 51' ' ' LEU . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 75.42 110.869 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.406 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 9.3 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 54.04 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.515 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 74.34 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 73.54 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.448 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.415 ' N ' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 74.25 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 75.24 110.87 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 75.43 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.564 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.553 ' CD2' HD23 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.448 ' CG1' HD12 ' A' ' 63' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 73.35 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.512 HG13 ' CE2' ' A' ' 27' ' ' PHE . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 74.21 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 20.5 m-70 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.12 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.401 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.463 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.525 ' CD2' HG22 ' A' ' 118' ' ' VAL . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 71.24 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 61.4 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 65.4 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.53 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.622 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 75.34 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 64.4 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.553 HD23 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 94' ' ' PHE . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 74.44 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.464 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.476 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 75.44 110.964 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 74.11 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.15 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.415 HD21 ' N ' ' A' ' 64' ' ' LYS . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.457 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 75.04 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 73.31 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 72.0 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.491 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.53 111.127 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.7 t . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 72.43 111.149 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.22 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 73.21 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 72.42 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 74.23 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 72.03 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.471 HD11 ' CA ' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.561 ' CD2' HD22 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.768 0.318 . . . . 72.43 110.884 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.503 HD13 ' CG ' ' A' ' 27' ' ' PHE . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.881 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.661 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 75.51 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 70.12 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 74.13 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.445 HG13 ' CE2' ' A' ' 74' ' ' PHE . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.52 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.441 ' N ' HD11 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 63.13 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.912 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.463 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.43 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.463 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.13 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.488 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 74.1 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.488 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.51 110.898 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 74.13 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.417 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 75.22 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 73.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.414 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.445 ' CE2' HG13 ' A' ' 49' ' ' VAL . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.42 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 95' ' ' ILE . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 72.44 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 75.3 110.932 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.412 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 23.0 m-70 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 75.31 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.41 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 75.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.561 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.521 ' CG ' HG21 ' A' ' 118' ' ' VAL . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 74.23 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' VAL . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 74.32 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 70.52 110.898 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.45 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 74.43 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 63.41 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 74.52 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.661 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 110' ' ' TYR . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 74.41 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.521 HG21 ' CG ' ' A' ' 94' ' ' PHE . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.31 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.34 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 75.23 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.471 ' CA ' HD11 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 70.22 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 70.14 110.918 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 62.24 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 74.2 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.53 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 74.22 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.448 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.51 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.954 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 75.04 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.47 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.4 ' C ' ' N ' ' A' ' 140' ' ' LEU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.4 ' N ' ' C ' ' A' ' 138' ' ' THR . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 73.04 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.24 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 74.22 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.133 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.809 0.338 . . . . 74.3 111.136 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.472 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 75.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' ASP . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 74.24 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 73.51 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 71.12 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.445 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 74.53 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CE2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.41 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.32 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.557 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 75.11 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.42 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.816 0.341 . . . . 73.1 110.879 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 73.42 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.1 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 70.44 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.522 HD12 ' CG ' ' A' ' 27' ' ' PHE . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 73.22 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 73.35 110.871 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 72.32 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.592 HG11 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.32 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.24 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.439 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.472 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.439 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.43 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 61.54 110.898 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.533 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 72.35 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.475 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 72.22 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 72.1 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 74.2 110.908 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 75.3 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 73.22 110.958 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 65.33 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.429 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 64.44 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.573 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.567 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 72.03 111.171 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.504 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.436 ' N ' HG13 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 73.15 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 75.03 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 64.22 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 75.21 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.21 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.525 HD21 ' CE2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.432 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.522 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.42 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 74.32 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.45 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 75.12 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 72.1 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.12 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.592 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 73.42 111.117 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 50.44 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 74.44 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.567 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 72.52 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.449 HD13 ' CG1' ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.522 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 71.2 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 75.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.443 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.12 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.445 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.418 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.449 ' O ' ' CB ' ' A' ' 124' ' ' THR . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' THR . . . . . 0.449 ' CB ' ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.575 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.544 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 73.31 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 74.12 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 75.13 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 70.03 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.45 ' HB3' ' CG2' ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.469 ' HA ' ' CE3' ' A' ' 139' ' ' TRP . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.34 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.5 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 75.11 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.904 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.575 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.432 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.1 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.835 0.35 . . . . 75.54 111.177 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 62.03 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 74.5 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 65.24 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.25 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 63.42 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 73.04 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.463 ' CG ' HD11 ' A' ' 38' ' ' ILE . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 73.32 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.43 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.851 0.358 . . . . 70.25 110.877 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 74.01 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 75.41 111.131 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.463 HD11 ' CG ' ' A' ' 27' ' ' PHE . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 73.44 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.419 ' NZ ' ' OD1' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.646 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.419 ' OD1' ' NZ ' ' A' ' 41' ' ' LYS . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 74.11 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 71.53 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.455 HD23 ' N ' ' A' ' 53' ' ' ASP . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 51' ' ' LEU . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 75.3 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.0 110.905 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.508 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 73.33 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.496 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.496 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 54.01 110.897 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.467 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 72.35 110.91 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 62.14 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.456 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 74.45 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 73.45 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.467 ' CG1' HD12 ' A' ' 63' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.33 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 74.4 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 62.25 111.154 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 74.41 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 75.32 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.452 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.45 112.345 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.42 110.938 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.44 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 74.32 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 74.45 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 55.22 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 74.15 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.12 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.12 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.646 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.42 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 74.33 112.494 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 63.22 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 74.41 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.44 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 71.44 111.155 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 64.43 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 75.2 111.104 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 75.1 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 74.15 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 74.1 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 74.3 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.428 ' N ' ' O ' ' A' ' 132' ' ' THR . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 74.5 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 74.33 111.136 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 72.53 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.416 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.416 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 73.01 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 64.45 110.821 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.777 0.322 . . . . 71.0 111.178 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.43 ' O ' ' C ' ' A' ' 17' ' ' ASP . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.53 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 74.11 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD2' HD23 ' A' ' 24' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.34 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 75.14 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 74.15 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.468 HD23 ' CD2' ' A' ' 20' ' ' LEU . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.33 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.22 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.567 ' CD1' HD12 ' A' ' 38' ' ' ILE . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.33 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.25 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.795 0.331 . . . . 65.12 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.567 HD12 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.864 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.64 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.11 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.885 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 63.33 110.91 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 75.22 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.51 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.474 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 74.02 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 73.3 110.934 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.32 110.894 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 72.43 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 71.44 111.106 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 73.35 110.936 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.538 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.4 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 73.54 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 75.23 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.419 ' CG1' ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.419 ' N ' ' CG1' ' A' ' 82' ' ' VAL . 26.5 m-70 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 74.34 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 74.35 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.416 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.519 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 61.1 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 75.01 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.508 ' CD2' ' CG2' ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.21 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 73.24 111.116 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.549 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 54.23 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.54 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 74.1 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 64.44 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.64 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.549 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 74.21 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 73.4 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 74.23 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.508 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.459 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.459 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 74.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 73.05 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 64.42 110.965 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 64.51 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 75.23 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 65.03 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 54.23 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 51.24 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.55 110.853 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 72.44 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' A' ' 145' ' ' ALA . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.824 0.345 . . . . 75.44 111.174 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG2' HG22 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 73.13 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 72.25 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 75.03 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 73.23 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 74.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.562 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 74.34 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.575 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.575 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 72.24 110.926 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 120.805 0.336 . . . . 75.41 110.901 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 72.03 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.415 ' HB1' ' CD1' ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 ' CG ' ' A' ' 27' ' ' PHE . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 72.24 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.428 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.52 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.432 ' CE ' HG22 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.35 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.626 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.02 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 70.44 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.43 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.404 ' O ' ' CB ' ' A' ' 17' ' ' ASP . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.452 ' N ' HD11 ' A' ' 20' ' ' LEU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 75.23 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 63.11 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 72.33 110.838 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.456 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.9 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.503 ' O ' ' CD1' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 75.31 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 65.34 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 66' ' ' GLU . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 75.31 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.495 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.451 ' CD2' HG23 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 74.44 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.422 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 71.55 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.551 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.428 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.415 ' C ' HG22 ' A' ' 75' ' ' VAL . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.451 HG23 ' CD2' ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 71.53 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.432 HG22 ' CE ' ' A' ' 40' ' ' MET . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 74.34 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 74.14 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 73.43 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 74.33 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 52.12 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.516 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.3 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 63.25 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.528 ' CD2' ' CG2' ' A' ' 118' ' ' VAL . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 70.35 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.418 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 74.12 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 74.12 110.875 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.406 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 63.23 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 73.32 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 75.43 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 75.24 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 74.0 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.626 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 73.11 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.418 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.528 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 74.52 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 64.14 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.464 HG22 ' CG2' ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 71.22 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.478 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 71.34 110.858 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 75.53 111.109 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 73.31 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.49 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 74.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 61.2 111.126 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.23 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 71.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 136' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 71.11 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 75.24 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.49 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.457 HD11 ' CG ' ' A' ' 79' ' ' TYR . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 72.01 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.412 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 72.51 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.443 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 71.43 111.12 179.787 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.813 0.339 . . . . 71.12 111.125 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.48 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 65.0 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 75.14 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 75.03 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 71.42 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.47 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 64.25 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 73.51 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.529 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 75.33 110.83 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--O 1.23 0.036 0 CA-C-O 120.788 0.327 . . . . 74.1 110.875 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 71.51 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 61.2 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.409 ' HB3' ' CD1' ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.512 HD13 ' CG ' ' A' ' 27' ' ' PHE . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 64.04 111.101 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.435 ' HE2' ' CG2' ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.619 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 71.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 75.41 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 70.34 111.14 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD22 ' N ' ' A' ' 53' ' ' ASP . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.34 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.461 ' N ' HD22 ' A' ' 51' ' ' LEU . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.425 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 71.02 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.434 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 74.44 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.434 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.533 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 74.01 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.409 ' CD1' ' HB3' ' A' ' 37' ' ' ALA . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 75.53 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 74.33 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.471 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 75.02 110.991 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.416 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.565 ' CD2' HD21 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 74.12 111.211 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.435 ' CG2' ' HE2' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.517 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 70.04 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.411 ' CG2' HG22 ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.53 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 75.11 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 75.4 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.411 HG22 ' CG2' ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.504 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.467 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 72.15 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 74.51 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 74.34 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 73.33 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 74.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 72.33 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.619 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 74.54 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 75.15 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 75.41 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.565 HD21 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.42 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.464 HG21 ' CE1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.469 ' CG2' HG23 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 74.42 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 54.42 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 71.43 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 75.35 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' A' ' 132' ' ' THR . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.54 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.45 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 74.14 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 138' ' ' THR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 72.42 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 74.11 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 73.34 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.467 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 74.42 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.32 111.089 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.824 0.345 . . . . 73.04 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 74.03 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.23 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 64.51 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 74.15 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.463 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.53 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 74.43 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 64.24 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.565 ' CD2' HD22 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.841 0.353 . . . . 72.1 110.9 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.404 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.549 HD13 ' CD2' ' A' ' 27' ' ' PHE . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.42 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.564 HG11 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 70.14 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.41 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 74.22 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 72.4 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.423 HD21 ' N ' ' A' ' 53' ' ' ASP . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.54 110.919 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.423 ' N ' HD21 ' A' ' 51' ' ' LEU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.468 ' CG ' HG22 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 74.03 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.512 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 73.03 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.47 HD11 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 74.14 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.491 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.485 ' CD2' HG23 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 64.44 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.569 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 60.34 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.505 ' HD2' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.447 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.33 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.485 HG23 ' CD2' ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 74.3 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.42 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.454 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.5 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.568 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 73.21 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.415 ' CG1' ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.415 ' N ' ' CG1' ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 72.35 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 73.21 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.568 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 74.02 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.565 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 74.42 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.421 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 64.31 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' A' ' 118' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.583 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 75.13 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.489 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.32 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.583 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 73.12 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.418 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.53 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.2 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.55 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.34 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.569 ' CE1' ' HG2' ' A' ' 72' ' ' PRO . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 71.23 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 70.22 112.458 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.401 ' CD ' ' CD2' ' A' ' 96' ' ' PHE . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.34 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 74.25 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' A' ' 74' ' ' PHE . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.56 HG21 ' CD2' ' A' ' 94' ' ' PHE . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.456 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.0 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.463 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 73.11 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.404 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 74.12 111.121 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 70.52 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 73.1 111.134 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 75.45 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.417 HG22 ' NH2' ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 72.32 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.469 ' O ' ' N ' ' A' ' 136' ' ' THR . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 74.45 110.884 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.408 ' N ' ' C ' ' A' ' 138' ' ' THR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 75.15 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.1 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 145' ' ' ALA . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.759 0.314 . . . . 75.41 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.469 HG23 ' CG2' ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 73.13 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.457 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 75.32 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 64.24 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.465 HD21 ' CD2' ' A' ' 20' ' ' LEU . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 71.52 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.54 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' HD13 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.529 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 75.24 110.913 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.499 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.852 0.358 . . . . 73.41 110.89 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 74.11 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.556 HD13 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.416 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.643 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 55.02 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.42 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.52 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 74.01 111.144 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.447 ' N ' HD11 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.896 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.406 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 74.3 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 74.21 110.975 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 72.41 110.887 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.432 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.416 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 62.52 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.571 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.432 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.524 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.482 HG12 ' CD2' ' A' ' 27' ' ' PHE . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 75.35 110.906 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 70.32 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' A' ' 88' ' ' VAL . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 75.45 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 75.42 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 75.23 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.564 ' CD2' HG21 ' A' ' 118' ' ' VAL . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 64.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 73.42 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 72.05 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 73.02 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 74.12 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.643 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 73.31 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 74.54 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.524 HD22 ' CD2' ' A' ' 74' ' ' PHE . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 75.34 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.564 HG21 ' CD2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.51 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.472 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 75.3 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.5 ' O ' ' NE ' ' A' ' 28' ' ' ARG . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 72.54 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 74.3 110.936 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.34 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 71.44 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 71.45 110.952 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.406 ' C ' ' N ' ' A' ' 140' ' ' LEU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.12 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.406 ' N ' ' C ' ' A' ' 138' ' ' THR . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 74.1 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 74.53 110.891 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.886 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 73.04 111.043 179.813 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.83 0.348 . . . . 74.25 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.474 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 17' ' ' ASP . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 71.12 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 23' ' ' THR . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 73.5 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 73.31 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.473 HD23 ' CD2' ' A' ' 20' ' ' LEU . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 73.51 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.548 ' CD1' HD13 ' A' ' 38' ' ' ILE . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 71.42 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 71.21 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 71.04 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.867 0.365 . . . . 73.22 110.865 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.05 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 74.41 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 74.23 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.548 HD13 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 75.41 111.155 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.465 ' HE3' ' CG2' ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.601 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 73.15 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.49 ' NH2' ' CG ' ' A' ' 43' ' ' ASP . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 63.45 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 74.12 110.905 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.474 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' A' ' 41' ' ' LYS . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.474 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 74.11 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.442 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.34 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.42 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.509 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 64.23 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.974 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.12 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 73.22 110.874 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.48 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 74.24 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 75.34 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 71.05 111.175 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.465 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 75.31 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 73.51 111.207 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.899 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 61.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 74.44 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 75.12 111.158 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.14 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 74.32 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.427 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 64.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.562 ' CZ ' HG23 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 73.05 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 74.42 111.133 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.45 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 74.11 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 74.52 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.41 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.434 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.601 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 74.42 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.507 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.562 HG23 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.413 ' CA ' HD12 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 73.04 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 75.53 111.116 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 74.05 111.147 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.05 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.547 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.35 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.13 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 63.25 111.148 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.547 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.441 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.441 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 72.44 110.924 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 72.21 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.43 111.14 179.744 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.874 0.369 . . . . 74.45 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 71.42 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 72.13 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 75.33 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 73.3 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD2' HD23 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.23 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.842 0.353 . . . . 71.54 110.859 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 64.23 111.072 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.461 ' HB1' ' CD1' ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 64.12 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.24 111.145 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.457 ' HE3' ' CG2' ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 72.15 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.653 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 45.24 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.424 HG13 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 74.4 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.445 HD21 ' N ' ' A' ' 53' ' ' ASP . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.445 ' N ' HD21 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.952 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.51 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 73.41 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.506 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.506 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.23 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 73.4 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.461 ' CD1' ' HB1' ' A' ' 37' ' ' ALA . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.44 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.464 ' CD2' ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 75.51 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.429 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.429 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 71.1 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 74.03 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.446 HG23 ' C ' ' A' ' 74' ' ' PHE . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.117 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.457 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.42 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 73.3 111.13 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 22.6 m-70 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.14 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 75.03 111.143 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.454 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 64.41 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 74.42 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.568 ' CD2' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 71.14 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.538 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.427 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 72.03 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 71.31 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 75.04 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 71.51 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 73.51 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 75.44 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.467 ' CE ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 73.43 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.653 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 73.05 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 65.54 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.21 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.552 HD22 ' CD2' ' A' ' 74' ' ' PHE . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.568 HG22 ' CD2' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 73.32 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.46 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 75.34 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.458 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 72.1 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.42 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 65.12 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 74.41 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 71.42 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 73.13 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.12 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 73.21 110.939 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 70.34 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.462 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 64.43 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.463 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 72.42 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 75.31 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.107 179.812 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.888 0.375 . . . . 72.51 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.32 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 70.12 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 73.42 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.461 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 73.23 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CD2' HD23 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.526 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.1 110.882 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.807 0.337 . . . . 74.51 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.515 HD13 ' CG ' ' A' ' 27' ' ' PHE . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.03 111.142 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' CG2' ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 72.13 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.66 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 74.15 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 74.44 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.4 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 64.0 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 64.31 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.464 ' N ' HD11 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 63.13 110.864 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 73.15 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.33 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.479 ' O ' ' CD1' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.42 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.495 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.495 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.467 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.472 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 73.42 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 74.1 110.929 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.422 HD22 ' NH1' ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.33 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.491 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.459 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.491 ' CZ ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.55 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.435 ' C ' HG22 ' A' ' 75' ' ' VAL . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.472 ' CG1' HD12 ' A' ' 63' ' ' LEU . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 74.43 111.154 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.455 ' CG2' ' HE2' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 74.11 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 75.42 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.168 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 72.41 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.21 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 75.22 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.519 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 73.54 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.553 ' CE1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 73.54 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.535 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 73.24 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.42 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 72.21 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 72.55 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 73.03 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.66 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 73.01 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.553 HG22 ' CE1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 75.22 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.42 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.461 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 74.1 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 64.32 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.43 111.105 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 75.41 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.42 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 74.42 110.929 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 72.3 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . 0.462 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 75.32 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.504 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.504 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 72.14 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 74.45 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 70.31 111.155 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.851 0.358 . . . . 61.0 111.133 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.458 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 74.32 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.458 ' C ' ' O ' ' A' ' 16' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.43 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 73.42 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 20' ' ' LEU . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.473 ' CD1' HD12 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.11 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 75.23 110.867 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.85 0.357 . . . . 74.02 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB3' ' CD1' ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 65.25 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.473 HD12 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 72.44 111.078 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 72.34 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 74.01 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 73.14 110.94 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 74.12 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.536 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.11 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.465 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 65.32 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.465 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 74.14 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.45 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.45 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 73.45 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.438 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.44 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 71.14 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 73.32 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' O ' ' SG ' ' A' ' 102' ' ' CYS . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 74.32 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.517 ' NE ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.462 ' CD2' HD23 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 74.23 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.52 111.097 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 73.32 111.145 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.527 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 62.25 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 74.0 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.42 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.505 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 64.44 110.852 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.56 ' CD2' HG23 ' A' ' 118' ' ' VAL . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 73.25 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.461 ' CG2' ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.43 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 52.02 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 75.15 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 74.52 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 65.43 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.571 ' CE2' HG11 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 75.01 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 70.45 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.43 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.462 HD23 ' CD2' ' A' ' 74' ' ' PHE . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.56 HG23 ' CD2' ' A' ' 94' ' ' PHE . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.465 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.44 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.497 ' O ' ' NE ' ' A' ' 28' ' ' ARG . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.41 110.915 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 74.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 75.11 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 63.04 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.5 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 75.45 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.482 ' O ' ' N ' ' A' ' 134' ' ' ASP . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.454 ' N ' ' O ' ' A' ' 132' ' ' THR . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 65.53 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 60.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 140' ' ' LEU . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 74.43 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.04 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 73.24 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 145' ' ' ALA . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.807 0.337 . . . . 73.25 111.092 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 72.33 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' ASP . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.49 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 23' ' ' THR . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 64.34 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.408 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.472 HD13 ' CA ' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 70.22 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 74.34 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.559 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.562 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.526 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.36 . . . . 73.1 110.902 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 60.34 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 73.42 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.427 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.5 111.099 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.474 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.32 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 55.13 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.568 HG13 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.44 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 74.55 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.41 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.411 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 64.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.41 ' N ' HD11 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 64.14 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.889 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.522 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.35 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.437 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.479 HD11 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 74.33 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 73.11 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.451 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 61.43 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.446 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 72.0 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 74.41 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.476 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.476 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.576 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.492 ' NE ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.479 ' CG1' HD11 ' A' ' 63' ' ' LEU . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.31 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.474 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.407 ' CB ' HD13 ' A' ' 95' ' ' ILE . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 75.15 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.914 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 71.43 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 74.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 45.55 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 75.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.089 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.25 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.417 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 72.12 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.32 112.318 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.463 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 52.03 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.562 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 63.54 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.407 HD13 ' CB ' ' A' ' 77' ' ' TYR . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 74.31 111.124 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.475 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.4 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 65.2 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 72.13 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.43 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 75.31 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 75.05 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 64.32 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.576 ' CE1' ' HG2' ' A' ' 72' ' ' PRO . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 73.03 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 64.01 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.472 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 71.34 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.21 110.931 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.562 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.423 HG21 ' CG2' ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 75.44 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.472 ' CA ' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.35 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 71.11 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 72.3 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.447 ' CG1' ' HA ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 75.23 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 75.35 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.439 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 61.55 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 73.41 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.42 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' A' ' 138' ' ' THR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.459 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 75.1 111.125 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.812 0.339 . . . . 63.41 111.114 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.484 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.45 HG23 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 64.41 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 55.14 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 23' ' ' THR . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 74.43 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 63.13 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 63.4 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.42 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.44 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 74.13 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CG ' HD11 ' A' ' 38' ' ' ILE . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 75.03 110.914 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.53 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.81 0.338 . . . . 73.14 110.931 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 65.31 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.538 ' CG2' ' CD1' ' A' ' 51' ' ' LEU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.403 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 64.34 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 50.44 110.86 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.579 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 72.54 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 72.12 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HB2' ' CE ' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 75.04 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 74.03 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.52 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.484 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 74.1 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 75.53 111.136 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.538 ' CD1' ' CG2' ' A' ' 38' ' ' ILE . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 64.33 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.406 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.913 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 4.5 m-80 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 75.11 110.885 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.513 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.25 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.471 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.44 110.796 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.441 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 74.35 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 75.11 110.892 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.472 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 74.04 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.491 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PHE . . . . . 0.567 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.407 HG23 ' C ' ' A' ' 74' ' ' PHE . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 72.32 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.515 HG11 ' CE2' ' A' ' 27' ' ' PHE . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 75.2 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 71.25 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.458 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.539 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.53 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 72.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.424 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 16.8 m-70 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.51 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.539 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . 0.441 ' CG ' HD12 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 74.23 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.433 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' CYS . . . . . 0.442 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 73.24 111.12 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 52.11 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.431 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 64.52 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 75.12 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 73.34 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 73.12 110.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.4 ' CE ' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 72.15 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.579 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 61.41 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 72.01 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 75.12 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.521 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.03 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 73.05 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.46 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 63.2 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 75.21 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 70.54 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 62.31 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 74.23 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ASP . . . . . 0.474 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 61.33 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.54 110.92 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 74.25 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.526 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 74.14 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' LEU . . . . . 0.441 HD12 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.45 111.118 179.858 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.511 -0.236 . . . . 73.5 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.96 -45.34 6.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 74.53 110.843 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -50.17 114.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 73.1 110.844 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 167.63 11.26 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.753 -0.737 . . . . 75.34 112.462 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 153.49 47.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 74.4 110.866 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 p -146.55 173.17 12.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 71.21 110.891 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.34 -91.64 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.734 -0.746 . . . . 74.32 112.506 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -84.96 159.05 20.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 73.34 110.844 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.58 81.58 1.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 64.02 110.877 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.7 m -174.32 138.91 0.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 74.24 110.871 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mt -133.01 -175.16 3.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 72.45 110.928 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.421 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 9.7 p -96.83 44.82 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 74.42 111.173 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -38.73 139.37 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 74.12 111.172 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.469 ' CG2' HG22 ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 74.42 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.5 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 75.01 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 75.34 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.33 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.545 ' CD2' HD13 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 74.23 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.573 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -73.63 165.63 24.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 74.13 110.854 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.69 33.67 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 70.12 110.888 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -113.89 175.25 5.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 74.34 110.839 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.4 p -148.19 26.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 73.54 111.102 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -126.13 -176.69 3.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 65.44 110.904 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 62.44 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 75.42 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.545 HD13 ' CD2' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 74.13 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.451 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.402 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 74.21 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 71.41 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.571 HG13 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 71.22 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 71.13 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 73.21 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 74.42 111.109 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 72.14 111.144 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.453 ' N ' HD13 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 70.02 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.32 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.509 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 75.05 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 75.33 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 73.51 110.915 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.481 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 71.42 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.44 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.437 ' CD2' HG23 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.471 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.4 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.432 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.471 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 74.2 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.42 ' C ' HG22 ' A' ' 75' ' ' VAL . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.437 HG23 ' CD2' ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 75.43 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 72.33 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.12 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.23 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 65.15 111.162 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 73.42 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 71.14 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 74.45 110.894 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 75.4 110.906 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.46 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 74.45 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 75.22 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 72.23 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 53.23 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 71.4 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 73.33 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 73.05 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 64.55 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 72.14 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 75.22 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.499 ' N ' ' O ' ' A' ' 106' ' ' GLN . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 74.24 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.571 ' CE2' HG13 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.15 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 73.3 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.44 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 73.2 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.46 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 75.0 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 72.52 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.469 HG22 ' CG2' ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.492 ' O ' ' CZ ' ' A' ' 28' ' ' ARG . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 75.52 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.915 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 75.54 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 71.32 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 73.34 111.146 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.35 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 72.04 110.954 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 74.4 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 70.3 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.406 ' C ' ' N ' ' A' ' 140' ' ' LEU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.422 HD12 ' CD2' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 63.34 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HD2' ' CZ ' ' A' ' 79' ' ' TYR . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 72.42 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -37.95 -72.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.43 76.08 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 72.42 110.858 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 61.42 145.72 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 55.53 112.47 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -168.69 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.67 2.247 . . . . 63.21 112.348 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.37 112.75 25.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.858 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.3 m 57.7 166.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 71.23 110.883 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 42.13 112.486 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 112.507 -0.237 . . . . 72.14 112.507 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -121.1 -50.3 2.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 73.44 110.842 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.8 t -174.91 -56.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 75.43 110.877 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.25 -144.74 39.8 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.705 -0.759 . . . . 71.41 112.476 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -134.1 -64.05 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.867 0.365 . . . . 74.11 110.826 -179.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.1 OUTLIER 79.21 -55.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 72.12 110.88 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.22 -84.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 71.33 112.568 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.8 131.5 51.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 72.22 110.834 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.56 86.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.495 . . . . 72.43 110.889 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 61.3 m -88.02 129.8 35.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.836 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mt -137.4 179.1 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 73.44 110.815 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 11.0 p -105.27 44.65 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 75.22 111.123 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.5 p -37.88 153.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.445 . . . . 72.35 111.106 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.469 HG21 ' CG2' ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.24 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 74.02 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 71.21 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 51' ' ' LEU . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 74.43 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.469 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.5 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 74.12 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.55 ' CD2' HD22 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 71.23 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.511 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 74.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' NE ' ' OE1' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -72.81 162.64 29.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -90.99 20.64 4.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 73.4 110.866 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.464 ' OE1' ' NE ' ' A' ' 30' ' ' ARG . 3.2 mp0 -100.51 179.34 4.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 64.31 110.9 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.8 p -151.57 26.54 0.66 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 73.43 111.155 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -127.02 -178.17 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 71.14 110.848 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 74.44 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 71.13 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.515 HD12 ' CG ' ' A' ' 27' ' ' PHE . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 74.52 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.408 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 65.33 110.861 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.648 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 74.41 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 75.2 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 75.12 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.411 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.465 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 75.04 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 75.43 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.525 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 75.12 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 55.32 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.434 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.891 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.434 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 73.01 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.31 110.901 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 51.23 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 65.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.413 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.564 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.408 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 74.03 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 73.21 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.43 HG11 ' CE2' ' A' ' 27' ' ' PHE . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.24 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 62.34 111.152 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 75.33 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.52 111.113 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 71.42 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 75.5 110.882 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.55 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.558 ' CD2' HG21 ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 75.34 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 75.52 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 74.21 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 74.03 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 75.53 112.314 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.32 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 75.34 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.44 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.648 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 53.31 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 70.14 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 75.12 110.893 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 74.34 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.48 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 72.33 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.558 HG21 ' CD2' ' A' ' 94' ' ' PHE . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.469 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 73.15 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.561 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.478 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 72.52 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 72.34 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 75.24 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 74.0 110.927 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 72.22 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.466 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.478 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.462 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 70.13 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.561 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.52 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -52.13 178.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 56.8 p -100.42 43.36 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 72.13 110.812 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 66.99 151.72 0.19 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 71.23 112.495 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -174.85 0.97 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 74.54 112.386 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.22 125.7 37.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 64.01 110.906 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 12.5 t -85.85 122.12 29.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.827 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.666 -0.778 . . . . 73.43 112.464 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.469 -0.252 . . . . 74.41 112.469 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -152.57 121.35 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.873 0.368 . . . . 70.52 110.878 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 66.41 123.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 73.51 110.906 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.433 ' O ' ' C ' ' A' ' 5' ' ' SER . . . 126.56 -46.26 1.1 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.706 -0.759 . . . . 73.13 112.434 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -35.83 121.0 0.63 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.848 0.356 . . . . 65.04 110.859 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 p -147.82 -52.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.117 -0.492 . . . . 74.4 110.862 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.0 -37.8 3.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.727 -0.749 . . . . 65.42 112.521 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.7 83.93 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.93 0.395 . . . . 72.21 110.896 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -173.09 76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 61.34 110.817 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 p 51.9 174.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 70.44 110.871 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mt -143.97 -173.82 4.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 62.52 110.892 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.441 HG13 ' CG ' ' A' ' 109' ' ' MET . 9.2 p -103.5 44.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 70.2 111.112 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -40.92 140.66 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.161 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 75.41 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 71.31 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 70.41 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.454 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 73.52 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.468 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.513 ' CG ' HD12 ' A' ' 38' ' ' ILE . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 74.34 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -70.04 162.69 27.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -85.84 30.3 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.871 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.442 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 22.2 mm-40 -114.39 177.11 4.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.875 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 p -149.73 30.43 0.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 62.24 111.184 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -129.64 175.31 8.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 65.33 110.917 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 64.04 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.449 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.513 HD12 ' CG ' ' A' ' 27' ' ' PHE . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.507 ' CG2' ' NE ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 75.01 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG22 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.63 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 73.45 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 65.31 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.419 HG13 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' N ' ' A' ' 52' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 71.43 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.451 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 65.3 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.544 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.493 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 64.24 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.493 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.404 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 66' ' ' GLU . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 74.54 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.83 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.459 ' CD2' HG23 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 74.45 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.32 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.453 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 74.44 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.556 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 63.23 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.507 ' NE ' ' CG2' ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.459 HG23 ' CD2' ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 75.21 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.439 HG22 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 74.11 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 74.5 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.428 HG13 ' N ' ' A' ' 83' ' ' HIS . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 74.02 111.154 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.428 ' N ' HG13 ' A' ' 82' ' ' VAL . 20.8 m-70 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 75.51 110.828 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 71.35 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 71.42 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.421 HG23 ' CG2' ' A' ' 82' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 71.41 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.505 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 75.45 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.564 ' CE1' HG21 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 70.55 110.892 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 60.51 112.312 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.453 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 74.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 63.42 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.63 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 75.24 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 73.22 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 73.01 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 73.41 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 74.31 110.847 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 64.33 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.564 HG21 ' CE1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 73.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 75.0 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' HG22 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.468 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 54.45 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 75.54 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 74.31 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.896 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.3 111.067 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.456 ' C ' ' O ' ' A' ' 131' ' ' THR . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.466 ' CD1' ' HB3' ' A' ' 63' ' ' LEU . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 74.33 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 70.21 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 72.52 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.58 -69.24 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 70.32 111.099 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.9 t -170.89 32.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 65.35 110.852 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.41 163.56 17.75 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 70.35 112.485 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 179.19 3.88 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.655 2.237 . . . . 64.1 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 30.4 t -67.45 -61.48 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 75.04 110.819 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 76.2 p -147.18 172.79 13.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 73.51 110.837 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.768 -0.729 . . . . 60.11 112.51 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.536 -0.226 . . . . 63.4 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -164.64 116.55 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.353 . . . . 55.24 110.972 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.12 90.93 8.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 64.41 110.814 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.54 166.57 12.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 72.13 112.451 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -178.59 -44.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.833 0.349 . . . . 73.2 110.848 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 t -76.85 -53.59 7.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 75.31 110.855 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 143.95 -155.51 26.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.767 -0.73 . . . . 64.02 112.476 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.02 -41.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 71.05 110.845 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -128.59 -141.47 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.839 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.8 p -108.81 151.73 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 64.23 110.891 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -143.88 -172.99 3.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.183 -0.462 . . . . 74.24 110.946 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -94.57 43.02 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.35 111.156 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.41 ' C ' ' O ' ' A' ' 12' ' ' VAL . 9.8 p -36.02 125.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 73.23 111.179 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.435 ' O ' ' C ' ' A' ' 17' ' ' ASP . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 64.54 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 61.42 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 64.11 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 72.34 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.452 HD22 ' CD2' ' A' ' 20' ' ' LEU . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 71.33 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 73.54 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 73.14 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.447 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.447 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.11 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -71.61 165.04 24.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.87 35.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 73.35 110.903 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 14.9 mt-10 -115.35 171.86 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 72.52 110.877 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.5 p -145.22 19.19 1.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.202 -0.454 . . . . 44.42 111.145 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -119.19 -179.1 3.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 72.31 110.855 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 63.4 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 74.33 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.512 HD12 ' CG ' ' A' ' 27' ' ' PHE . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 74.5 111.101 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.454 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.618 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 4.0 mm-40 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.928 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 72.15 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 73.25 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.429 ' N ' HD13 ' A' ' 20' ' ' LEU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 73.43 110.896 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.407 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.44 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 65.24 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.528 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.486 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 72.42 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 73.01 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 75.12 110.858 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 72.31 110.875 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.407 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 71.52 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.415 HD22 ' CG2' ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 74.42 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 71.13 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.426 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.426 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 72.43 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 73.41 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.562 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 63.15 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 74.23 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.415 ' CG2' HD22 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 72.32 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.454 HG23 ' CE ' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 72.41 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 75.44 111.133 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 110.858 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.3 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.146 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.443 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 75.51 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 71.51 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.858 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 71.4 110.862 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 72.2 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.618 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 70.04 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 61.11 112.539 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 74.42 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.23 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 72.33 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 71.12 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 75.0 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.434 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 72.54 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.437 ' O ' ' CB ' ' A' ' 122' ' ' GLU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 72.14 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.922 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 74.24 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 75.52 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 74.42 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 72.43 110.918 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 71.04 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 74.24 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 75.02 110.925 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.44 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.415 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 74.43 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.489 HD12 ' CD1' ' A' ' 79' ' ' TYR . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 75.55 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.891 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 65.22 110.924 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 74.23 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -41.04 -78.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 73.32 111.099 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 147' ' ' GLY . 8.3 t -156.75 33.14 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.893 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 146' ' ' SER . . . -35.61 148.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.747 -0.74 . . . . 70.24 112.58 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 114.88 3.85 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.666 2.244 . . . . 64.42 112.293 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.2 t -90.89 157.42 17.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 61.31 110.895 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.3 t -88.74 66.66 8.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.853 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.699 -0.763 . . . . 73.32 112.481 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.522 -0.231 . . . . 55.53 112.522 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.47 -57.22 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.826 0.346 . . . . 61.12 110.818 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.4 t 68.2 115.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.077 -0.511 . . . . 73.52 110.863 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.68 -87.63 1.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 74.41 112.468 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.62 41.65 3.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.945 0.402 . . . . 73.11 110.866 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.64 104.52 7.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.799 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 63.48 126.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.706 -0.759 . . . . 54.54 112.465 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.4 p -99.69 82.73 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 73.52 110.869 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -172.23 88.62 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 74.15 110.865 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 84.5 p -125.97 153.92 43.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 71.41 110.849 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 mt -136.08 -178.04 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.3 110.939 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' C ' ' A' ' 13' ' ' VAL . 14.4 p -106.33 45.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 71.31 111.141 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.404 ' C ' ' O ' ' A' ' 12' ' ' VAL . 7.4 p -36.42 153.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.227 -0.442 . . . . 73.54 111.149 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.466 HG23 ' CG2' ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 74.35 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.477 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 72.22 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.449 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 73.41 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.448 HD13 ' CA ' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 75.31 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.504 ' CG ' HD13 ' A' ' 38' ' ' ILE . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.465 ' NE ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.71 157.88 24.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 73.34 110.92 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 32.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 74.3 110.945 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.465 ' HB2' ' NE ' ' A' ' 30' ' ' ARG . 60.7 mm-40 -104.1 179.06 4.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 65.25 110.906 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.7 p -155.94 22.63 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.22 111.182 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -123.09 -175.66 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 64.22 110.87 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 73.42 111.085 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.504 HD13 ' CG ' ' A' ' 27' ' ' PHE . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 72.4 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 71.55 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 71.43 110.906 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.599 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 75.22 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 73.32 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 73.15 111.096 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.456 HD23 ' N ' ' A' ' 53' ' ' ASP . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 73.23 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.456 ' N ' HD23 ' A' ' 51' ' ' LEU . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 75.04 110.848 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.5 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.1 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.526 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.34 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.495 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.495 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 72.22 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 75.0 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.41 110.894 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 73.43 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 75.12 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 70.41 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 72.34 111.111 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 71.55 111.109 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 71.04 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 75.03 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 64.54 111.065 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 74.42 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 74.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.54 111.106 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 65.35 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 75.2 112.381 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.478 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 75.31 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 72.45 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.442 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.46 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 73.34 111.015 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 75.51 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 62.4 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 64.42 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 71.1 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.599 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.34 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 63.43 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 64.03 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.46 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 74.24 110.898 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.442 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 70.22 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.466 ' CG2' HG23 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.448 ' CA ' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 71.32 110.965 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.05 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.51 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 75.5 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.55 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 70.21 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 70.23 110.984 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.53 110.924 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 70.41 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 71.12 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -40.87 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.52 69.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 72.0 110.794 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 56.15 172.95 0.15 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.733 -0.746 . . . . 75.34 112.494 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 106.23 1.63 Allowed 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.727 2.285 . . . . 74.1 112.315 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 158.77 17.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 65.04 110.893 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 68.0 m -39.18 132.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 74.41 110.892 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 74.14 112.469 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.5 -0.24 . . . . 64.53 112.5 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -124.55 161.57 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.937 0.398 . . . . 74.21 110.818 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m 61.01 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 71.45 110.9 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.93 -61.86 0.3 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.802 -0.713 . . . . 51.3 112.478 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.78 109.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.842 0.353 . . . . 73.24 110.866 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 t -135.72 -46.41 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 71.34 110.839 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.1 108.31 0.27 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 55.52 112.499 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 t -129.16 175.12 8.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 73.52 110.784 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.8 79.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.061 -0.518 . . . . 74.1 110.885 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.95 174.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 64.42 110.846 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 mt -143.8 -174.79 4.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 73.42 110.97 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -92.04 42.16 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 74.41 111.113 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t -41.25 106.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 75.32 111.148 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 17' ' ' ASP . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 74.51 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 75.1 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD2' HD23 ' A' ' 24' ' ' LEU . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.476 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 70.32 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.569 ' CD1' HD12 ' A' ' 38' ' ' ILE . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 75.01 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.566 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -94.2 -177.11 4.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.42 110.804 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.452 ' O ' ' C ' ' A' ' 32' ' ' GLU . 6.9 mptt -60.69 -13.48 14.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.467 . . . . 73.4 110.913 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.468 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 7.4 mt-10 33.57 -134.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.919 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.568 ' HA ' ' CE1' ' A' ' 90' ' ' TYR . 2.6 p 51.03 16.97 0.39 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 55.02 111.151 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER -155.75 119.92 4.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 64.15 110.9 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.569 HD12 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.1 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 70.23 110.878 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.622 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 71.2 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.463 ' CA ' ' HE3' ' A' ' 109' ' ' MET . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 73.52 110.964 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 74.52 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.406 ' CG ' HG12 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 62.13 111.187 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.406 HG12 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 65.42 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.469 HD23 ' N ' ' A' ' 53' ' ' ASP . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 74.33 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 74.04 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.469 ' N ' HD23 ' A' ' 51' ' ' LEU . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 75.42 110.869 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.406 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 9.3 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 54.04 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.515 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 74.34 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 73.54 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.448 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.415 ' N ' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 74.25 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 75.24 110.87 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 75.43 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.564 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.553 ' CD2' HD23 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.448 ' CG1' HD12 ' A' ' 63' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 73.35 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.512 HG13 ' CE2' ' A' ' 27' ' ' PHE . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 74.21 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 20.5 m-70 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.12 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.463 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.525 ' CD2' HG22 ' A' ' 118' ' ' VAL . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 71.24 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 61.4 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 65.4 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.53 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.622 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 75.34 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 64.4 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.553 HD23 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 94' ' ' PHE . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 74.44 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.464 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.476 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 75.44 110.964 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 74.11 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.15 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 73.24 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.415 HD21 ' N ' ' A' ' 64' ' ' LYS . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.457 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 75.04 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 73.31 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 72.0 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.491 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.55 -68.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.53 111.127 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.11 38.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 71.45 110.819 -179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 90.21 146.39 15.39 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.793 -0.717 . . . . 72.11 112.436 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.87 -171.97 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.64 2.227 . . . . 74.32 112.29 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 37.9 t -87.18 128.41 35.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 71.31 110.89 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.06 91.89 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 72.23 110.867 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.676 -0.773 . . . . 64.1 112.43 -179.976 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.46 -0.256 . . . . 71.42 112.46 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m 58.27 110.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.905 0.383 . . . . 65.42 110.845 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 97.4 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 63.12 110.924 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.41 106.4 0.28 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.736 -0.745 . . . . 72.34 112.477 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.39 163.87 12.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.841 0.353 . . . . 75.1 110.855 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 t -97.5 89.57 4.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 75.22 110.873 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 55.84 95.38 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.777 -0.725 . . . . 70.12 112.466 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.8 p 177.16 166.49 0.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.837 0.351 . . . . 53.54 110.817 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.96 119.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.816 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.403 ' C ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 p -67.9 139.37 56.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 55.42 110.881 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.403 ' HG ' ' C ' ' A' ' 10' ' ' SER . 4.4 mt -146.73 -164.58 2.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 73.44 110.928 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.411 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -101.65 38.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.086 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' C ' ' O ' ' A' ' 12' ' ' VAL . 89.7 t -36.2 103.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 72.43 111.149 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.22 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 73.21 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 72.42 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 74.23 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 72.03 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 HD11 ' CA ' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.561 ' CD2' HD22 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -78.72 172.18 14.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.62 37.82 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.42 110.918 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 7.7 mm-40 -110.89 178.35 4.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.913 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 72.6 p -153.53 29.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.169 -0.468 . . . . 72.51 111.137 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -133.71 174.39 10.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 72.43 110.884 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.503 HD13 ' CG ' ' A' ' 27' ' ' PHE . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.881 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.661 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 75.51 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 70.12 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 74.13 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.445 HG13 ' CE2' ' A' ' 74' ' ' PHE . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.52 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.441 ' N ' HD11 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 63.13 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.912 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.463 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.43 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.463 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.506 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 73.13 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.488 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 74.1 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.488 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.51 110.898 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 74.13 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.417 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 75.22 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.417 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 73.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.414 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.445 ' CE2' HG13 ' A' ' 49' ' ' VAL . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.42 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 95' ' ' ILE . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 72.44 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 75.3 110.932 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.412 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 23.0 m-70 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 75.31 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.41 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 75.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.561 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.521 ' CG ' HG21 ' A' ' 118' ' ' VAL . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 74.23 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.401 ' N ' ' O ' ' A' ' 75' ' ' VAL . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 74.32 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 70.52 110.898 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.45 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 74.43 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 63.41 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 74.52 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.661 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 110' ' ' TYR . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 74.21 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 74.41 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.424 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.521 HG21 ' CG ' ' A' ' 94' ' ' PHE . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.31 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.34 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 75.23 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.471 ' CA ' HD11 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 70.22 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 70.14 110.918 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 62.24 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 74.2 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.53 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 74.22 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.448 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 72.51 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 75.45 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 74.42 110.954 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 75.04 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.47 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.4 ' C ' ' N ' ' A' ' 140' ' ' LEU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.24 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.4 ' N ' ' C ' ' A' ' 138' ' ' THR . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 73.04 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.24 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 74.22 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.64 -62.78 1.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.133 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.96 39.78 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.33 110.903 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -52.42 154.27 5.66 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.728 -0.749 . . . . 73.13 112.461 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 101.94 0.96 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.663 2.242 . . . . 62.43 112.4 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.9 175.29 7.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 64.32 110.826 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.72 103.1 10.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 64.45 110.819 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.773 -0.727 . . . . 70.42 112.415 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.47 -0.252 . . . . 44.04 112.47 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 p -127.86 163.12 25.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.354 . . . . 75.25 110.856 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.4 m -80.82 -54.0 5.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.485 . . . . 75.41 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.17 98.46 1.27 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.11 112.495 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.49 -67.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.886 0.374 . . . . 71.52 110.801 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -176.11 157.98 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 72.03 110.866 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.42 -135.93 2.67 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.768 -0.73 . . . . 71.44 112.502 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 t -151.59 154.05 35.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 63.33 110.908 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.41 45.44 0.96 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 72.45 110.954 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 m -162.41 131.76 4.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 65.43 110.867 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -135.85 -175.01 3.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.3 110.906 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.413 ' CG2' ' O ' ' A' ' 12' ' ' VAL . 9.0 p -95.87 44.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.167 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p -39.52 149.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.09 -0.505 . . . . 74.3 111.136 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.472 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 75.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 74.44 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.453 ' O ' ' C ' ' A' ' 17' ' ' ASP . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 74.24 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 73.51 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.47 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 71.12 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.445 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 74.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 74.53 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CE2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.41 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 70.32 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.557 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 75.11 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.42 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -71.55 166.29 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -96.35 34.51 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 75.34 110.972 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.08 179.0 4.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 64.02 110.873 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.0 p -149.02 20.3 0.98 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.218 -0.446 . . . . 75.42 111.182 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -122.78 -179.8 4.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 73.1 110.879 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 73.42 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.1 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 70.44 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.522 HD12 ' CG ' ' A' ' 27' ' ' PHE . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 73.22 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 73.35 110.871 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 72.32 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.592 HG11 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.32 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.24 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 75.24 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.439 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.472 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.439 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.43 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.416 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 61.54 110.898 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.533 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 72.35 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.475 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 72.22 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 72.1 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 74.2 110.908 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 75.3 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 73.22 110.958 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 65.33 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.429 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 64.44 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.573 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.567 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 72.03 111.171 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 73.32 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.504 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.436 ' N ' HG13 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 73.15 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 75.03 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 64.22 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 75.21 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 73.21 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.525 HD21 ' CE2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 75.24 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.432 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.522 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.42 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 74.32 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.45 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 75.12 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 72.1 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.12 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 74.54 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.592 ' CE2' HG11 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 73.42 111.117 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 50.44 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 74.44 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.567 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 72.52 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.449 HD13 ' CG1' ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.522 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 71.2 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 75.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.443 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 71.12 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.445 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.418 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.449 ' O ' ' CB ' ' A' ' 124' ' ' THR . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.449 ' CB ' ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.575 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.544 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 73.31 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 74.12 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 75.13 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 70.03 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.45 ' HB3' ' CG2' ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.469 ' HA ' ' CE3' ' A' ' 139' ' ' TRP . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.34 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.5 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 75.11 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 74.12 110.904 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.575 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.432 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.57 -56.77 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.6 p -79.47 47.52 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 75.24 110.919 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.97 147.04 49.03 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.684 -0.769 . . . . 63.04 112.537 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 179.94 3.33 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.728 2.286 . . . . 64.41 112.327 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.3 t -50.87 154.16 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 71.02 110.883 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.2 t 71.57 93.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.813 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.761 -0.733 . . . . 53.42 112.445 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.529 -0.228 . . . . 64.43 112.529 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.3 m -55.45 166.9 0.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.845 0.355 . . . . 74.51 110.852 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.4 p -165.79 145.17 6.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.31 110.922 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 5' ' ' SER . . . -68.03 149.42 50.21 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 75.52 112.5 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 4' ' ' GLY . 24.5 m -35.61 -47.68 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 74.44 110.884 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.443 ' O ' ' C ' ' A' ' 7' ' ' GLY . 1.4 t -173.04 -55.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 75.33 110.766 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' A' ' 6' ' ' SER . . . 34.56 -130.13 0.55 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 62.24 112.534 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -152.62 29.92 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 50.41 110.83 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 59.08 46.28 13.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.41 110.858 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.7 m -132.74 137.72 46.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 72.23 110.859 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.467 HD13 ' CA ' ' A' ' 112' ' ' GLY . 8.7 mt -136.35 -169.29 2.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 73.4 110.952 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.434 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.3 t -95.38 41.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 73.42 111.143 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 12' ' ' VAL . 97.1 t -34.69 108.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 75.54 111.177 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 62.03 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.478 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 74.5 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 65.24 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.484 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.25 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 63.42 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 73.04 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.463 ' CG ' HD11 ' A' ' 38' ' ' ILE . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 73.32 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.43 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -73.08 172.65 10.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.91 37.12 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.2 110.892 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 27.3 mt-10 -116.59 169.77 9.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 64.12 110.89 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.4 p -142.72 22.29 1.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 75.32 111.124 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -121.27 -174.23 2.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 70.25 110.877 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 74.01 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 74.4 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 75.41 111.131 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.463 HD11 ' CG ' ' A' ' 27' ' ' PHE . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 73.44 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.419 ' NZ ' ' OD1' ' A' ' 43' ' ' ASP . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.646 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.419 ' OD1' ' NZ ' ' A' ' 41' ' ' LYS . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 74.11 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 71.53 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.455 HD23 ' N ' ' A' ' 53' ' ' ASP . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.455 ' N ' HD23 ' A' ' 51' ' ' LEU . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 75.3 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 75.0 110.905 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.508 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 73.33 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.496 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.496 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 54.01 110.897 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.467 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 72.35 110.91 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 62.14 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.456 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 74.45 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 73.45 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.467 ' CG1' HD12 ' A' ' 63' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.33 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 74.4 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 62.25 111.154 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 74.41 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 75.32 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.452 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.45 112.345 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.42 110.938 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.44 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 74.32 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 74.45 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 55.22 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 74.15 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 71.12 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 75.12 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.646 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 74.42 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . 0.467 ' CA ' HD13 ' A' ' 11' ' ' LEU . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 74.33 112.494 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 63.22 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 75.31 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 74.41 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.44 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 71.44 111.155 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.43 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 64.43 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 75.2 111.104 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 75.1 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 74.15 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 74.1 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 74.3 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.428 ' N ' ' O ' ' A' ' 132' ' ' THR . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 74.5 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 74.33 111.136 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 72.53 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.416 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.416 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 73.01 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 64.45 110.821 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.19 -60.8 1.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.3 t -178.55 43.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 63.34 110.896 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -68.43 -170.99 6.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.757 -0.735 . . . . 74.15 112.46 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -176.88 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.721 2.281 . . . . 74.24 112.257 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 27.6 t -171.17 85.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 64.43 110.904 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.7 m -135.8 88.28 2.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 65.33 110.822 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 53.24 112.479 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.55 -0.22 . . . . 72.51 112.55 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.78 170.81 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.839 0.352 . . . . 61.43 110.909 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 m 51.45 98.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 65.42 110.799 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.08 -67.97 0.52 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.779 -0.724 . . . . 60.31 112.534 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.2 m -64.5 148.67 50.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.888 0.375 . . . . 73.42 110.871 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.9 m -133.52 161.54 34.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.914 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.0 -42.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.79 -0.719 . . . . 43.12 112.525 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m 42.16 43.72 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.836 0.35 . . . . 72.11 110.856 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -125.84 -141.03 0.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 52.23 110.898 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.1 m -140.66 143.63 35.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 74.41 110.869 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.9 mt -133.08 179.22 6.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.463 . . . . 75.21 110.912 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.449 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.7 t -92.95 38.07 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 75.55 111.175 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.449 ' C ' ' O ' ' A' ' 12' ' ' VAL . 2.3 p -34.0 145.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 71.0 111.178 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 72.34 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.43 ' O ' ' C ' ' A' ' 17' ' ' ASP . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.53 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 74.11 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.468 ' CD2' HD23 ' A' ' 24' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.34 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 75.14 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 74.15 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.468 HD23 ' CD2' ' A' ' 20' ' ' LEU . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.33 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 75.22 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.567 ' CD1' HD12 ' A' ' 38' ' ' ILE . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 73.33 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 71.25 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.11 163.07 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.42 27.18 1.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.854 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -103.92 171.44 7.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 65.52 110.867 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.8 p -150.35 32.63 0.65 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 75.54 111.169 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -131.4 -179.39 5.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 65.12 110.857 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.567 HD12 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 75.24 110.864 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.64 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.11 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.885 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 71.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 63.33 110.91 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 75.22 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.51 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.474 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 74.02 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 74.12 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 71.04 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 73.3 110.934 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.32 110.894 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 72.43 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.457 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.445 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 71.44 111.106 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 73.35 110.936 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.538 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.4 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 73.54 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 75.23 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.419 ' CG1' ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.419 ' N ' ' CG1' ' A' ' 82' ' ' VAL . 26.5 m-70 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 74.34 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 74.35 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.416 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.519 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 61.1 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 75.01 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.508 ' CD2' ' CG2' ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.21 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 73.24 111.116 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.549 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 54.23 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.54 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 74.1 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 64.44 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.64 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.549 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 74.21 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 73.4 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.458 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 74.23 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.508 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.459 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.459 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 74.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 73.05 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 64.42 110.965 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 64.51 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 75.23 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 65.03 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 54.23 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 73.13 110.85 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 51.24 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 72.55 110.853 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 72.44 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.418 ' O ' ' C ' ' A' ' 145' ' ' ALA . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.39 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 30.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 74.4 110.912 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.75 149.47 13.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.739 -0.743 . . . . 63.53 112.407 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 6.62 1.25 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.272 . . . . 73.43 112.32 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.2 t -116.17 -61.47 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 72.0 110.799 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 9.0 t -83.4 44.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 73.23 110.88 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.76 -0.734 . . . . 74.42 112.439 -179.928 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.512 -0.235 . . . . 71.4 112.512 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 m 38.79 80.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 73.35 110.903 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.22 -45.07 88.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 73.51 110.838 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.48 105.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.729 -0.748 . . . . 75.32 112.426 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.67 -62.66 1.65 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.877 0.37 . . . . 60.1 110.829 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.75 177.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.895 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -40.64 103.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 63.32 112.476 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.6 m -100.65 83.48 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 74.33 110.853 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -175.53 83.78 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 75.14 110.909 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.1 159.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 70.15 110.834 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -141.05 -176.11 4.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 75.53 110.889 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' CYS . 9.2 t -90.59 37.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 74.41 111.184 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.419 ' C ' ' O ' ' A' ' 12' ' ' VAL . 93.5 t -36.14 95.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 75.44 111.174 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.444 ' N ' ' O ' ' A' ' 12' ' ' VAL . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.464 ' CG2' HG22 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 73.13 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 72.25 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 75.03 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 73.23 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.478 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 74.0 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.562 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 74.34 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.575 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.575 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -73.67 161.67 30.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 72.24 110.926 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -86.77 31.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.973 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 68.4 mm-40 -112.52 174.56 5.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 73.03 110.91 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 75.2 p -147.99 32.88 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 73.22 111.122 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.81 178.49 7.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 75.41 110.901 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 72.03 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.415 ' HB1' ' CD1' ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.521 HD13 ' CG ' ' A' ' 27' ' ' PHE . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 72.24 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.428 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.52 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.432 ' CE ' HG22 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 75.13 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 73.35 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.626 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 71.02 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 70.44 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.43 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.404 ' O ' ' CB ' ' A' ' 17' ' ' ASP . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.452 ' N ' HD11 ' A' ' 20' ' ' LEU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.433 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 75.23 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 63.11 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 72.33 110.838 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.456 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.9 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.503 ' O ' ' CD1' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 75.31 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 65.34 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 66' ' ' GLU . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 75.31 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.495 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.471 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.451 ' CD2' HG23 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 74.44 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.422 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 71.55 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.406 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.551 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.428 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.415 ' C ' HG22 ' A' ' 75' ' ' VAL . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.451 HG23 ' CD2' ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 71.53 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.432 HG22 ' CE ' ' A' ' 40' ' ' MET . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 74.34 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 74.14 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 73.43 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 74.33 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 52.12 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.516 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.562 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.3 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 63.25 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.528 ' CD2' ' CG2' ' A' ' 118' ' ' VAL . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 70.35 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.418 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 74.12 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 74.12 110.875 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.406 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 63.23 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 73.32 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 75.43 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 75.24 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 74.0 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.626 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 73.11 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.418 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.517 HD13 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.528 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 74.52 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 64.14 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.464 HG22 ' CG2' ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 71.22 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.478 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 71.34 110.858 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 75.53 111.109 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 73.31 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.49 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 74.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 61.2 111.126 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.23 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 71.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 136' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 64' ' ' LYS . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.468 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 71.11 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 75.24 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.49 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.457 HD11 ' CG ' ' A' ' 79' ' ' TYR . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 72.01 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.412 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 72.51 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.443 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -53.87 -60.71 2.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 71.43 111.12 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.84 44.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 74.43 110.821 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -45.37 151.77 0.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.718 -0.753 . . . . 53.02 112.528 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -174.11 0.85 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.678 2.252 . . . . 72.02 112.369 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 13.4 m -120.37 -62.56 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.293 -0.412 . . . . 64.34 110.859 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.59 103.0 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.23 110.871 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.716 -0.754 . . . . 75.14 112.516 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.464 -0.254 . . . . 73.3 112.464 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 113.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.858 0.361 . . . . 71.1 110.888 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.9 t -170.84 42.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 75.22 110.81 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.81 -165.26 32.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.698 -0.763 . . . . 70.12 112.491 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 t -157.97 139.35 13.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.919 0.39 . . . . 75.54 110.853 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.0 p -133.78 165.79 24.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.099 -0.501 . . . . 74.11 110.861 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -45.42 -82.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.701 -0.761 . . . . 55.2 112.573 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -66.92 149.93 49.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 73.11 110.866 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.46 83.36 2.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.82 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 94.0 p -118.14 148.05 42.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.42 110.872 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.6 mt -136.94 176.99 8.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.35 110.96 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.424 ' CG1' ' HA ' ' A' ' 109' ' ' MET . 13.7 p -92.96 43.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 75.33 111.071 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -37.64 152.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.245 -0.434 . . . . 71.12 111.125 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.48 ' CG1' ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 65.0 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 75.14 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 75.03 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 71.42 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.47 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 64.25 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 73.51 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.529 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.78 169.74 17.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 75.33 110.83 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 36.68 1.6 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 75.13 110.886 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 6.3 mm-40 -106.8 -177.9 3.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 74.5 110.832 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 p -156.16 21.6 0.37 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 61.22 111.223 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -126.72 177.27 6.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 74.1 110.875 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 71.51 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 61.2 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.409 ' HB3' ' CD1' ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.512 HD13 ' CG ' ' A' ' 27' ' ' PHE . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 64.04 111.101 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.435 ' HE2' ' CG2' ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.619 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 71.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 75.41 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 70.34 111.14 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD22 ' N ' ' A' ' 53' ' ' ASP . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 75.34 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.461 ' N ' HD22 ' A' ' 51' ' ' LEU . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.425 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 71.02 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.434 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 74.44 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.434 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.533 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 74.01 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.409 ' CD1' ' HB3' ' A' ' 37' ' ' ALA . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 75.53 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 74.33 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.471 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.44 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 75.02 110.991 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.416 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.565 ' CD2' HD21 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 74.12 111.211 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.435 ' CG2' ' HE2' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.517 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 70.04 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.411 ' CG2' HG22 ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 75.53 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 75.11 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 75.4 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.411 HG22 ' CG2' ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.504 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.529 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 74.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.467 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 72.15 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.464 ' CE1' HG21 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 74.51 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 74.34 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 73.33 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 74.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 72.33 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.619 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 74.54 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 75.15 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 75.41 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.565 HD21 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 75.42 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.464 HG21 ' CE1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.469 ' CG2' HG23 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 74.42 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.47 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 54.42 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 71.43 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 75.35 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' A' ' 132' ' ' THR . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.54 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 72.45 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 74.14 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.469 ' N ' ' O ' ' A' ' 138' ' ' THR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 72.42 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 74.11 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 73.34 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.467 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 74.42 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -37.92 -67.81 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.32 111.089 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.53 42.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 73.55 110.82 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -58.66 170.62 4.82 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 61.42 112.515 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 -176.58 1.54 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.655 2.237 . . . . 74.22 112.289 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.11 -52.14 1.65 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 55.44 110.869 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.6 150.78 25.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 75.12 110.884 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.852 -0.69 . . . . 53.1 112.429 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 112.489 -0.244 . . . . 73.4 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 53.9 170.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.941 0.401 . . . . 73.32 110.832 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.9 t -164.81 170.52 15.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.809 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.09 -96.1 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 74.31 112.47 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -155.62 85.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.927 0.394 . . . . 72.33 110.879 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 178.09 169.73 0.74 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.048 -0.524 . . . . 53.02 110.897 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.33 -92.39 1.23 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.749 -0.739 . . . . 74.4 112.554 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -162.51 -45.6 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 74.35 110.864 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 39.94 84.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 73.22 110.896 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.5 m -91.66 123.13 34.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.52 110.832 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.444 HD11 ' CA ' ' A' ' 112' ' ' GLY . 7.6 mt -133.83 -167.29 1.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 73.13 110.899 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.8 t -98.12 50.19 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 72.34 111.178 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t -42.08 112.76 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 73.04 111.159 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 74.03 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.23 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 74.4 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.456 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 64.51 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 74.15 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.463 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.53 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 74.43 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 64.24 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.565 ' CD2' HD22 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -76.05 155.79 34.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 30.58 0.62 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 73.33 110.884 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.418 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 28.4 mt-10 -108.88 172.55 6.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 65.31 110.911 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.7 p -146.46 33.72 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 64.14 111.11 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.27 173.55 11.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.1 110.9 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.404 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.549 HD13 ' CD2' ' A' ' 27' ' ' PHE . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.42 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.564 HG11 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 70.14 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.41 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 74.22 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 72.4 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.423 HD21 ' N ' ' A' ' 53' ' ' ASP . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 74.54 110.919 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.423 ' N ' HD21 ' A' ' 51' ' ' LEU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.468 ' CG ' HG22 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 74.03 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.512 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 73.03 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.47 HD11 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 74.14 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.491 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.485 ' CD2' HG23 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 64.44 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.569 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 60.34 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.505 ' HD2' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.447 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.33 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.485 HG23 ' CD2' ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 74.3 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.42 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.454 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.5 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.568 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 73.21 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.415 ' CG1' ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.415 ' N ' ' CG1' ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 72.35 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 73.21 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.568 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 74.02 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.565 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 74.42 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.421 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 64.31 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.56 ' CD2' HG21 ' A' ' 118' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.583 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 75.13 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.489 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.32 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.583 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 73.12 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.418 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.53 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.2 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.55 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 74.34 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.569 ' CE1' ' HG2' ' A' ' 72' ' ' PRO . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 71.23 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . 0.444 ' CA ' HD11 ' A' ' 11' ' ' LEU . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 70.22 112.458 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.401 ' CD ' ' CD2' ' A' ' 96' ' ' PHE . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.34 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 74.25 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.447 HD22 ' CD2' ' A' ' 74' ' ' PHE . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.56 HG21 ' CD2' ' A' ' 94' ' ' PHE . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.456 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 72.0 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.463 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 73.11 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.404 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 74.12 111.121 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 70.52 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 73.1 111.134 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 75.45 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.417 HG22 ' NH2' ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 72.32 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.469 ' O ' ' N ' ' A' ' 136' ' ' THR . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 74.45 110.884 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.408 ' N ' ' C ' ' A' ' 138' ' ' THR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 75.15 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 75.1 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.425 ' O ' ' C ' ' A' ' 145' ' ' ALA . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.05 -69.01 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -173.75 39.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 71.2 110.861 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 78.35 145.72 2.81 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.76 -0.733 . . . . 72.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 115.2 3.98 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.676 2.251 . . . . 64.52 112.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 5.8 t -124.84 136.47 53.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 73.3 110.844 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 78.4 p -100.09 131.71 45.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.846 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 34.03 112.501 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.423 -0.271 . . . . 62.3 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -112.45 128.55 56.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.88 0.371 . . . . 45.11 110.886 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.2 p 41.23 89.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 74.21 110.844 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.91 153.28 9.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.726 -0.749 . . . . 63.42 112.555 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 m 58.58 166.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 64.13 110.865 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.51 109.68 10.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 62.44 110.828 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -167.69 -178.87 40.05 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 61.33 112.475 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -76.02 123.38 25.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.937 0.399 . . . . 64.43 110.786 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 23.3 p-10 -160.26 85.14 0.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 75.53 110.939 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.6 m -90.64 129.81 36.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 73.33 110.866 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.5 mt -130.71 176.2 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 74.55 110.926 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.453 ' CG2' ' O ' ' A' ' 12' ' ' VAL . 7.9 p -92.7 43.24 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 73.33 111.187 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.407 ' C ' ' O ' ' A' ' 12' ' ' VAL . 57.8 t -35.81 145.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.41 111.127 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.469 HG23 ' CG2' ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 73.13 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.457 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 75.32 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 64.24 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.465 HD21 ' CD2' ' A' ' 20' ' ' LEU . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 71.52 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.54 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' HD13 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.529 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -88.07 -174.82 4.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 75.24 110.913 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.482 ' O ' ' C ' ' A' ' 32' ' ' GLU . 1.9 mttm -62.32 -8.65 6.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 71.42 110.902 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' A' ' 31' ' ' LYS . 1.6 mp0 31.21 -135.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 74.34 110.884 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.566 ' HA ' ' CE1' ' A' ' 90' ' ' TYR . 2.2 p 51.71 16.47 0.48 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 64.24 111.14 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.499 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.7 OUTLIER -155.03 120.07 4.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 73.41 110.89 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 73.23 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 74.11 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.556 HD13 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.416 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 74.45 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.643 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 55.02 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.42 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.52 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 74.01 111.144 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.447 ' N ' HD11 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.896 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.406 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 74.3 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 74.21 110.975 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 71.52 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.496 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.451 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 72.41 110.887 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.432 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.416 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 62.52 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.571 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.432 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.524 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.482 HG12 ' CD2' ' A' ' 27' ' ' PHE . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 75.35 110.906 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 70.32 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . 0.423 ' CG2' HG21 ' A' ' 88' ' ' VAL . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 75.45 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 74.33 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 75.42 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.423 HG21 ' CG2' ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 75.23 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.566 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.564 ' CD2' HG21 ' A' ' 118' ' ' VAL . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 64.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 73.42 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 72.05 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 73.02 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 74.12 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.643 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 73.31 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 74.54 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 74.21 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.524 HD22 ' CD2' ' A' ' 74' ' ' PHE . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 75.34 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.564 HG21 ' CD2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.51 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.472 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 75.3 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.5 ' O ' ' NE ' ' A' ' 28' ' ' ARG . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 72.54 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 74.3 110.936 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.34 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 73.41 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 71.44 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 71.45 110.952 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.406 ' C ' ' N ' ' A' ' 140' ' ' LEU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 71.12 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.406 ' N ' ' C ' ' A' ' 138' ' ' THR . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 74.1 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 74.53 110.891 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 73.22 110.886 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.89 -75.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 73.04 111.043 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.36 34.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 65.43 110.815 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 67.91 179.82 16.66 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 71.1 112.457 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -175.14 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.666 2.244 . . . . 75.55 112.313 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.33 154.44 16.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 71.21 110.852 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.39 165.65 32.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 65.31 110.946 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 74.25 112.447 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.48 -0.248 . . . . 63.41 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -161.43 -57.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.877 0.37 . . . . 65.3 110.838 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.27 140.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.3 110.843 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.16 -144.24 18.36 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.751 -0.737 . . . . 61.42 112.567 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.2 p -155.96 129.92 8.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 74.52 110.841 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.0 p -120.13 164.58 15.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 74.25 110.868 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.09 133.08 6.22 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 74.11 112.489 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.5 t -40.76 152.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 60.31 110.891 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -102.6 42.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 73.43 110.889 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.5 m -137.83 117.83 13.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 73.31 110.901 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.6 mt -129.44 -179.43 5.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 74.51 110.944 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.462 ' CG1' ' HA ' ' A' ' 109' ' ' MET . 8.0 p -95.74 39.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 75.11 111.196 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.446 ' C ' ' O ' ' A' ' 12' ' ' VAL . 76.2 t -34.08 122.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 74.25 111.096 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.474 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.49 ' O ' ' C ' ' A' ' 17' ' ' ASP . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 71.12 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 23' ' ' THR . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 73.5 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 73.31 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.473 HD23 ' CD2' ' A' ' 20' ' ' LEU . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 73.51 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.548 ' CD1' HD13 ' A' ' 38' ' ' ILE . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 71.42 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 71.21 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.466 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -69.17 176.89 2.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 71.04 110.968 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.38 39.25 1.86 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 75.32 110.901 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.466 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 11.6 mt-10 -119.45 174.33 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.881 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.6 p -147.75 32.42 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 70.52 111.14 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -135.42 -174.88 3.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.247 -0.433 . . . . 73.22 110.865 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.05 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 74.41 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 74.23 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.548 HD13 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 75.41 111.155 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.465 ' HE3' ' CG2' ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.601 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 73.15 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.49 ' NH2' ' CG ' ' A' ' 43' ' ' ASP . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 63.45 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 74.12 110.905 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.474 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' A' ' 41' ' ' LYS . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.474 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 74.11 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.442 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.34 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.42 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.509 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 64.23 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.974 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.12 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 73.22 110.874 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.48 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 74.24 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 75.34 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 71.05 111.175 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.465 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 75.31 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 73.51 111.207 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.899 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 61.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 74.44 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 75.12 111.158 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.14 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 74.32 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.427 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 64.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.562 ' CZ ' HG23 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 73.05 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 74.42 111.133 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.45 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 74.11 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 74.52 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.41 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.462 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.601 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 74.42 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.507 ' CD1' ' C ' ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.562 HG23 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.413 ' CA ' HD12 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 73.04 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 75.53 111.116 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 74.05 111.147 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.05 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.547 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.35 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 73.13 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.463 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 63.25 111.148 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.547 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.441 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.441 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 72.44 110.924 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 72.21 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.95 -60.38 3.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 55.43 111.14 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.7 p -86.32 31.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 72.24 110.916 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 42.65 -162.21 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.727 -0.749 . . . . 74.44 112.558 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -173.81 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.694 2.263 . . . . 65.41 112.365 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 51.0 m 44.79 91.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 75.34 110.869 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 53.2 p -160.09 127.02 4.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 73.44 110.851 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 73.13 112.517 -179.971 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.518 -0.233 . . . . 75.54 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -153.84 -48.89 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 64.12 110.799 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 93.6 p -121.42 154.01 37.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.45 110.832 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 -81.2 0.2 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.783 -0.723 . . . . 65.11 112.47 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.02 167.79 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 70.01 110.825 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -66.36 176.47 1.81 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 62.14 110.883 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.72 -166.54 24.53 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 65.32 112.419 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -136.37 138.27 41.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.891 0.377 . . . . 72.31 110.812 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -171.25 46.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.53 110.826 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.84 163.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 70.22 110.812 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 mt -136.13 177.41 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 75.12 110.909 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.413 ' CG1' ' HG2' ' A' ' 109' ' ' MET . 10.0 p -93.9 43.69 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 75.52 111.082 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t -40.26 119.73 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 74.45 111.063 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 71.42 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 72.13 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 75.33 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.458 ' CD1' ' HB3' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 73.3 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.454 ' CD2' HD23 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.411 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.23 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 -65.7 172.3 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -98.02 31.04 2.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 73.31 110.923 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -123.38 171.26 9.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.21 110.855 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 p -140.3 37.05 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 75.01 111.199 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -132.25 174.77 9.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 71.54 110.859 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 64.23 111.072 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.461 ' HB1' ' CD1' ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 64.12 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 75.24 111.145 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.457 ' HE3' ' CG2' ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 72.15 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.653 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.24 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 45.24 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.424 HG13 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 74.4 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.445 HD21 ' N ' ' A' ' 53' ' ' ASP . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.445 ' N ' HD21 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.952 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.51 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 73.41 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.506 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.506 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.23 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 73.4 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.461 ' CD1' ' HB1' ' A' ' 37' ' ' ALA . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.44 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.464 ' CD2' ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 75.51 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.429 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.429 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 71.1 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 74.03 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.552 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.446 HG23 ' C ' ' A' ' 74' ' ' PHE . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.117 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.457 ' CG2' ' HE3' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 75.42 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 73.3 111.13 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 22.6 m-70 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 75.41 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.12 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.14 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 75.03 111.143 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.454 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 64.41 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 74.42 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.568 ' CD2' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 71.14 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.538 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.427 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 72.03 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 71.31 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 75.04 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 71.51 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 74.25 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 73.51 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 75.44 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.467 ' CE ' HG23 ' A' ' 42' ' ' VAL . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 73.43 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.653 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 73.05 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 65.54 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 75.21 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.552 HD22 ' CD2' ' A' ' 74' ' ' PHE . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.568 HG22 ' CD2' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 73.32 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.46 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 75.34 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.458 ' HB3' ' CD1' ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 72.1 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.42 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 65.12 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 74.41 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 71.42 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 73.13 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.12 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 73.21 110.939 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 70.34 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.462 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 64.43 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.463 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 75.32 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.463 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 72.42 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.553 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 75.31 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -54.78 -178.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.107 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -161.88 87.01 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.04 110.827 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -125.62 -158.91 10.12 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 75.44 112.528 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.79 -174.56 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.734 2.289 . . . . 75.24 112.351 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.25 114.73 22.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 71.1 110.907 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.73 120.58 37.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.33 110.798 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 C-N-CA 120.737 -0.744 . . . . 51.22 112.478 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.516 -0.234 . . . . 70.32 112.516 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 114.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.849 0.357 . . . . 63.42 110.819 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -46.83 134.44 10.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 72.24 110.823 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.54 -49.37 4.17 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.716 -0.754 . . . . 53.24 112.512 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.1 t -64.26 133.34 52.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.928 0.394 . . . . 75.44 110.882 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.03 -48.8 0.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 74.43 110.824 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.08 72.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.758 -0.734 . . . . 73.15 112.447 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.1 m -45.24 -59.64 2.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 74.13 110.87 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.21 84.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 73.31 110.863 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.3 p 49.5 179.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 73.23 110.928 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.445 HD12 ' CA ' ' A' ' 112' ' ' GLY . 4.0 mt -140.51 -172.08 3.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 72.43 110.911 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -92.88 44.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.151 -0.477 . . . . 74.34 111.122 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t -39.09 114.29 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 72.51 111.098 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.32 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 70.12 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 73.42 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.461 ' CD1' ' HB1' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 73.23 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.519 ' CD2' HD23 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 73.32 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.526 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.21 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -68.28 165.34 18.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.1 110.882 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.09 20.16 6.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 73.52 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -101.75 168.96 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 72.42 110.856 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.5 p -141.02 36.38 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 60.23 111.141 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -138.5 172.9 12.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 74.51 110.876 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 73.31 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.515 HD13 ' CG ' ' A' ' 27' ' ' PHE . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.03 111.142 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.455 ' HE2' ' CG2' ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 63.42 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 72.13 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.66 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 74.15 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 74.44 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.4 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 64.0 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 64.31 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.464 ' N ' HD11 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 63.13 110.864 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 73.15 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.33 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.479 ' O ' ' CD1' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.42 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.495 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.495 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.467 ' O ' ' CD2' ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.472 HD12 ' CG1' ' A' ' 75' ' ' VAL . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 73.42 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 74.1 110.929 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.422 HD22 ' NH1' ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.33 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.491 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.415 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.415 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.459 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.491 ' CZ ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.55 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.435 ' C ' HG22 ' A' ' 75' ' ' VAL . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.472 ' CG1' HD12 ' A' ' 63' ' ' LEU . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 74.43 111.154 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.455 ' CG2' ' HE2' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 74.11 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 75.42 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 74.33 111.168 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 72.41 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 74.21 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 75.22 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.519 HD23 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 73.54 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.553 ' CE1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 73.54 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.535 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 73.24 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.42 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 72.21 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.415 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 72.55 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 73.03 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.66 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . 0.445 ' CA ' HD12 ' A' ' 11' ' ' LEU . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.535 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 73.01 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.553 HG22 ' CE1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 75.22 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.462 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.42 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.461 ' HB1' ' CD1' ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 74.1 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 64.32 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.43 111.105 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.558 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 75.41 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.42 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 74.42 110.929 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 72.3 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.462 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 75.32 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.504 ' CD1' ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.504 ' N ' ' CD1' ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 72.14 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.558 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 74.45 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.45 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.84 -173.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 70.31 111.155 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 17.7 t -162.65 88.47 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 74.54 110.818 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -116.67 -165.62 14.05 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.642 -0.789 . . . . 72.23 112.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 5.49 1.7 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.637 2.225 . . . . 62.34 112.313 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 53.4 p -61.01 158.95 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 71.54 110.898 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.02 155.32 34.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 71.15 110.753 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.668 -0.777 . . . . 63.21 112.444 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.482 -0.247 . . . . 71.52 112.482 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -140.58 144.35 35.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 75.13 110.876 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.49 -54.69 2.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 75.2 110.853 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.39 40.43 0.8 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.67 -0.776 . . . . 73.03 112.526 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.6 m 60.39 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.827 0.346 . . . . 71.1 110.873 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.9 m -161.85 -45.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.472 . . . . 75.13 110.871 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -119.07 176.33 16.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.811 -0.709 . . . . 65.14 112.496 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.84 -59.92 1.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 64.24 110.883 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.94 42.17 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 72.33 110.891 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -157.57 157.13 33.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 75.51 110.891 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.1 mt -128.36 -179.79 5.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.919 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.48 ' CG2' ' O ' ' A' ' 12' ' ' VAL . 7.1 p -100.22 41.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 74.51 111.033 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t -39.23 127.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 61.0 111.133 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.458 ' O ' ' C ' ' A' ' 17' ' ' ASP . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 74.32 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.458 ' C ' ' O ' ' A' ' 16' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.43 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 73.42 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.469 ' CD2' HD22 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.465 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 ' CD2' ' A' ' 20' ' ' LEU . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.473 ' CD1' HD12 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 73.44 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 74.24 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.11 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -76.02 173.75 10.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 75.23 110.867 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mmmt -103.01 39.4 1.56 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.4 110.894 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 38.8 mm-40 -110.09 176.1 5.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.901 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.1 p -145.97 10.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 73.44 111.157 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -116.74 -177.55 3.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.02 110.876 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB3' ' CD1' ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 65.25 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.473 HD12 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 72.44 111.078 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.571 HG11 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 72.34 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 74.01 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.468 ' N ' HD13 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 73.14 110.94 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 74.12 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.536 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.11 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.465 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 65.32 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.465 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 74.14 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.45 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.45 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 73.45 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.438 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.44 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 71.14 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 73.32 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' O ' ' SG ' ' A' ' 102' ' ' CYS . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 74.32 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.517 ' NE ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.462 ' CD2' HD23 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 74.23 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.52 111.097 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 73.32 111.145 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.527 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 62.25 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 74.0 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 75.44 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.42 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.505 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 64.44 110.852 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.56 ' CD2' HG23 ' A' ' 118' ' ' VAL . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 73.25 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.461 ' CG2' ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.43 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 52.02 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 75.15 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 74.52 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 65.43 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.571 ' CE2' HG11 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 75.01 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 70.45 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.43 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.462 HD23 ' CD2' ' A' ' 74' ' ' PHE . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.56 HG23 ' CD2' ' A' ' 94' ' ' PHE . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.465 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 71.44 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.497 ' O ' ' NE ' ' A' ' 28' ' ' ARG . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.41 110.915 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 74.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.21 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 75.11 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.538 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 63.04 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.5 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 75.45 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.482 ' O ' ' N ' ' A' ' 134' ' ' ASP . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.454 ' N ' ' O ' ' A' ' 132' ' ' THR . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 65.53 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 60.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.401 ' C ' HD13 ' A' ' 140' ' ' LEU . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 74.43 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.04 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 73.24 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' A' ' 145' ' ' ALA . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.74 -65.84 0.26 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 65.1 m -116.31 44.86 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.837 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 45.12 -155.01 0.42 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.734 -0.746 . . . . 54.53 112.496 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 117.53 5.14 Favored 'Trans proline' 0 C--O 1.23 0.11 0 C-N-CA 122.72 2.28 . . . . 75.3 112.318 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 3.7 m -104.42 -48.81 3.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 63.44 110.847 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 35.6 t -87.15 86.03 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 75.1 110.816 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.783 -0.723 . . . . 63.25 112.537 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.465 -0.254 . . . . 63.12 112.465 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 t -130.66 127.75 39.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.865 0.364 . . . . 72.2 110.88 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.92 118.82 21.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 53.01 110.831 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.84 82.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 73.4 112.522 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -153.2 149.37 27.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.369 . . . . 71.54 110.829 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.08 170.9 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 63.32 110.786 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.57 83.51 0.72 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.787 -0.72 . . . . 61.12 112.471 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -85.96 154.07 21.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 73.13 110.809 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -134.67 89.11 2.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.076 -0.511 . . . . 72.41 110.905 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.4 t 55.42 164.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.223 -0.444 . . . . 64.14 110.869 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -138.46 -171.55 3.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 75.53 110.962 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 9.0 p -104.8 45.58 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.245 -0.434 . . . . 73.34 111.202 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -39.01 132.35 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 73.25 111.092 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 72.33 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.451 ' O ' ' C ' ' A' ' 17' ' ' ASP . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.49 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 23' ' ' THR . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 64.34 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.408 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 HD13 ' CA ' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 70.22 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 74.34 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.559 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.562 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.526 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -87.34 -175.72 5.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.439 ' O ' ' C ' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -66.26 -16.1 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 72.02 110.913 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 27.1 mt-10 34.87 -136.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 74.02 110.888 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.59 ' HA ' ' CE1' ' A' ' 90' ' ' TYR . 4.5 p 59.51 10.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 72.23 111.114 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER -152.59 118.55 5.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 73.1 110.902 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 60.34 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 73.42 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.427 ' HB2' ' CD1' ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.5 111.099 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.474 ' HE1' ' CG2' ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.32 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 55.13 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.568 HG13 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 75.44 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 74.55 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.41 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.411 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 64.0 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.41 ' N ' HD11 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 64.14 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.8 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 75.24 110.889 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.522 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 71.35 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.437 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.479 HD11 ' CG1' ' A' ' 75' ' ' VAL . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 74.33 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 73.11 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.451 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 61.43 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.446 ' HB3' ' NH2' ' A' ' 73' ' ' ARG . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 72.0 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 74.41 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.476 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.476 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.576 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.492 ' NE ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.479 ' CG1' HD11 ' A' ' 63' ' ' LEU . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.31 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.474 ' CG2' ' HE1' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.407 ' CB ' HD13 ' A' ' 95' ' ' ILE . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 75.15 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.914 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 71.43 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 74.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 45.55 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 75.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 74.3 111.089 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.25 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.59 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 72.12 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.32 112.318 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.463 HD22 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 73.44 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 52.03 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.562 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 63.54 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.407 HD13 ' CB ' ' A' ' 77' ' ' TYR . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 74.31 111.124 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.475 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.4 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 65.2 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 72.13 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.43 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 75.31 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 75.05 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 74.44 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 64.32 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.25 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.576 ' CE1' ' HG2' ' A' ' 72' ' ' PRO . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 73.03 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 64.01 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.472 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 71.34 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 72.21 110.931 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.562 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.423 HG21 ' CG2' ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 75.44 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.472 ' CA ' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 74.35 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.47 ' CD1' ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 71.11 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 72.3 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.447 ' CG1' ' HA ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 75.23 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 75.35 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.439 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 61.55 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 73.41 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.42 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.437 ' N ' ' O ' ' A' ' 138' ' ' THR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 71.11 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.459 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.1 -71.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 75.1 111.125 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.12 37.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 71.2 110.854 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -50.9 162.68 1.1 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.702 -0.761 . . . . 72.4 112.546 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.68 107.82 1.93 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.728 2.285 . . . . 75.12 112.362 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 94.5 p -133.05 132.0 41.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 74.23 110.885 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 97.6 p -122.32 106.36 11.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 74.41 110.841 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 C-N-CA 120.761 -0.733 . . . . 65.21 112.463 179.95 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.435 -0.266 . . . . 74.51 112.435 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 -48.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.845 0.355 . . . . 63.14 110.846 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.17 126.93 35.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 70.25 110.838 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.23 -113.98 1.39 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.701 -0.761 . . . . 62.11 112.484 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.1 p -101.09 177.33 4.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.968 0.413 . . . . 74.51 110.811 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -175.65 171.58 2.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.879 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.45 -154.51 8.9 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.775 -0.726 . . . . 64.13 112.48 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.84 177.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.812 0.339 . . . . 55.35 110.893 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.5 80.07 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 72.45 110.861 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -175.87 127.38 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 74.23 110.88 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.5 mt -138.18 -177.52 4.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 73.21 110.941 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.418 ' O ' ' C ' ' A' ' 13' ' ' VAL . 9.5 t -89.36 35.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 61.42 111.149 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' VAL . 7.4 p -36.47 134.73 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 63.41 111.114 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.484 ' SG ' ' CG2' ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.45 HG23 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 64.41 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 55.14 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 23' ' ' THR . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 74.43 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 63.13 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 63.4 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' CD1' ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.42 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.44 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 74.13 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.517 ' CG ' HD11 ' A' ' 38' ' ' ILE . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.533 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -86.82 175.85 8.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 75.03 110.914 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -112.48 37.91 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.254 -0.43 . . . . 74.01 110.879 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 9.7 mm-40 -100.59 -44.03 5.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 74.32 110.913 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.1 p 46.72 34.26 2.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 74.3 111.155 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.53 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 0.5 OUTLIER -140.2 134.27 30.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 73.14 110.931 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 65.31 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.538 ' CG2' ' CD1' ' A' ' 51' ' ' LEU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.403 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 64.34 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 50.44 110.86 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.579 ' CG1' ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 72.54 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 72.12 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HB2' ' CE ' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 75.04 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 74.03 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.52 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 75.24 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.484 ' CG2' ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 74.1 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 75.53 111.136 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.538 ' CD1' ' CG2' ' A' ' 38' ' ' ILE . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 64.33 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.406 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.913 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 4.5 m-80 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 75.11 110.885 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.513 ' CD1' ' C ' ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.25 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.471 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.44 110.796 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.441 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 74.35 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.406 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 75.11 110.892 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.472 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 74.04 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.472 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.491 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PHE . . . . . 0.567 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.407 HG23 ' C ' ' A' ' 74' ' ' PHE . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 72.32 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.515 HG11 ' CE2' ' A' ' 27' ' ' PHE . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 75.2 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 71.25 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.458 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.539 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.53 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 72.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.424 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 16.8 m-70 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 74.33 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.51 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.539 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.441 ' CG ' HD12 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 74.23 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.433 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' CYS . . . . . 0.442 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' PHE . . . . . 0.568 ' CE1' HD13 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 73.24 111.12 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 52.11 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.431 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 64.52 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 75.12 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 73.34 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 73.12 110.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.4 ' CE ' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 72.15 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.579 ' CE2' ' CG1' ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 61.41 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 72.01 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 75.12 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.568 HD13 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.521 ' CG2' ' CD2' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.03 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 73.05 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.46 ' CG2' ' HG3' ' A' ' 21' ' ' LYS . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.471 ' HB2' ' CD1' ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 63.2 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 75.21 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.41 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 70.54 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 62.31 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 74.23 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.474 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 61.33 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.54 110.92 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 74.25 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.526 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 74.14 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.441 HD12 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -47.59 -84.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 64.45 111.118 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 10.6 t -163.61 54.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 72.44 110.846 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -84.33 -156.63 24.73 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.702 -0.761 . . . . 73.55 112.457 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 6.59 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.609 2.206 . . . . 72.22 112.34 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.2 p -38.75 -46.02 1.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 73.42 110.888 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.9 t -41.47 159.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 70.52 110.841 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 54.54 112.464 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.798 0.332 . . . . 70.5 111.172 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.927 HG21 ' CG2' ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 72.44 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 65.52 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.41 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.142 HD13 ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 71.44 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 64.42 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.843 ' CD1' HD11 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 73.03 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.585 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 72.45 110.854 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 p30 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.833 0.349 . . . . 65.44 110.904 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 52.31 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 51.52 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.843 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 71.3 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.472 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.75 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 55.52 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 62.42 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.833 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 64.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 64.24 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 54.51 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.457 HG11 HD23 ' A' ' 117' ' ' LEU . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 73.43 111.109 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.463 ' C ' HD12 ' A' ' 20' ' ' LEU . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 65.34 111.144 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.62 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.04 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.809 ' HG3' HG23 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.452 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 62.33 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.983 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 72.11 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' HD23 ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.575 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 71.41 110.915 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.604 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 52.22 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.452 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 51.21 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.947 HD21 HG21 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.12 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 114' ' ' LYS . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 HD21 ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.75 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.33 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 61.12 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.04 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.605 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 64.22 111.162 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG22 ' A' ' 82' ' ' VAL . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.23 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 63.31 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.605 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 50.01 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 61.31 110.894 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.906 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 73.1 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 71.44 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 43.21 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 34.5 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 52.23 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 72.0 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 61.2 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 62.54 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.499 ' N ' ' O ' ' A' ' 106' ' ' GLN . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 52.04 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.833 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.04 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 71.22 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.417 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.13 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.927 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.142 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 94' ' ' PHE . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.915 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 72.11 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 64.21 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 71.13 111.146 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.583 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.34 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 35.21 110.954 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 71.34 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 53.34 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.417 HG22 ' HG3' ' A' ' 142' ' ' GLU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.73 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.04 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.73 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 50.1 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.417 ' HG3' HG22 ' A' ' 138' ' ' THR . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.583 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.03 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 65.0 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.422 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.5 p . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.869 0.366 . . . . 71.31 111.106 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' N ' HG22 ' A' ' 13' ' ' VAL . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.885 HG21 HG21 ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.2 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 65.43 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 70.42 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 40' ' ' MET . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 73.3 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 63.53 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.23 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 71.32 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CD2' HD21 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 33.21 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 70.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.428 ' N ' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 71.14 110.848 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 63.1 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 64.14 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 72.25 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.81 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.53 110.861 179.894 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.759 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 64.43 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 62.42 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 41.11 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 54' ' ' GLU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.1 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.729 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.456 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.965 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 63.35 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 53.53 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 64.42 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.685 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 65.22 110.891 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.456 ' HG3' HD13 ' A' ' 55' ' ' LEU . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.12 110.901 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 43.12 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 63.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.424 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.572 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.612 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 65.12 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.81 HG23 ' HE1' ' A' ' 40' ' ' MET . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.05 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 71.01 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.507 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.751 HG23 ' HB ' ' A' ' 88' ' ' VAL . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 53.53 111.152 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.436 ' H ' HG22 ' A' ' 82' ' ' VAL . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 61.34 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.751 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.21 111.113 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 64.0 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 72.43 110.882 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.468 ' HB2' HD22 ' A' ' 144' ' ' LEU . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.773 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.11 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.414 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 74.13 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 61.32 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 70.21 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 73.53 112.314 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 52.45 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 71.1 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.759 ' CE2' HG12 ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 45.04 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 45.24 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.628 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 63.53 110.893 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 64.1 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 63.1 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.724 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 70.32 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 114' ' ' LYS . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.885 HG21 HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 61.44 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 73.41 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.402 HG13 ' HD2' ' A' ' 94' ' ' PHE . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.526 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 71.33 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 62.43 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.452 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.23 110.927 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 62.51 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 142' ' ' GLU . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.89 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.89 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.15 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.51 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.468 HD22 ' HB2' ' A' ' 91' ' ' PRO . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.793 0.33 . . . . 65.14 111.161 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 63.11 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 62.12 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.493 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.11 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.473 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.9 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 55.14 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.781 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 73.32 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.835 0.35 . . . . 65.33 110.917 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.44 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.874 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.543 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.685 HG21 ' CZ ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.674 ' CE ' HG23 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.776 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 71.52 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.881 HG11 HD13 ' A' ' 117' ' ' LEU . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.432 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.816 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 65.32 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.55 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.816 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.454 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.937 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.499 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 61.42 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.894 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.874 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 62.45 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.73 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.13 110.83 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.73 HD22 ' HG2' ' A' ' 64' ' ' LYS . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.872 HD21 HG21 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 44.53 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.02 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.451 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 52.1 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.56 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 31.21 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.685 ' CZ ' HG21 ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.872 HG21 HD21 ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 73.45 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.674 HG23 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.45 ' HD1' ' HB2' ' A' ' 37' ' ' ALA . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 53.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 63.43 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 74.3 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 72.32 111.154 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.828 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 51.4 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 60.53 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 88' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 55.1 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.781 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 144' ' ' LEU . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.755 ' CD1' HG22 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 77' ' ' TYR . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 63.55 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 53.13 110.892 -179.801 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 55.04 112.312 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.451 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 61.12 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.776 ' CE2' HG12 ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 71.22 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 61.12 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 72.4 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 70.11 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 118' ' ' VAL . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.03 110.847 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 55.43 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.881 HD13 HG11 ' A' ' 49' ' ' VAL . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.755 HG22 ' CD1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 64.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.71 HG21 HG21 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.9 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 52.15 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 94' ' ' PHE . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 62.02 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.0 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.567 ' CG2' HG11 ' A' ' 118' ' ' VAL . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.464 ' HE2' ' HG ' ' A' ' 93' ' ' CYS . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.401 HG22 ' HB3' ' A' ' 134' ' ' ASP . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 63.52 111.067 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.5 HG22 ' HB2' ' A' ' 67' ' ' LEU . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.894 HD22 ' O ' ' A' ' 60' ' ' PRO . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 50.5 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 70.41 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 93' ' ' CYS . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.43 111.099 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.763 0.316 . . . . 73.23 111.179 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 55.13 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 50.41 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 60.43 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.559 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.067 HD13 ' HB2' ' A' ' 121' ' ' ALA . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.822 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 53.23 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.0 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.55 ' N ' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.871 0.367 . . . . 64.0 110.855 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 53.25 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 71.14 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 ' CG ' ' A' ' 54' ' ' GLU . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.576 ' CG1' HG22 ' A' ' 75' ' ' VAL . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 63.41 111.101 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.835 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 4.0 mm-40 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 50.45 110.928 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.35 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.789 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.789 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 72.15 110.896 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.33 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.456 ' O ' HG22 ' A' ' 58' ' ' ILE . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 62.54 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.955 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.491 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 65.53 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 52.03 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.405 ' OE2' HD12 ' A' ' 65' ' ' LEU . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 73.52 110.858 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.632 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 71.2 110.875 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.405 HD12 ' OE2' ' A' ' 62' ' ' GLU . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.49 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 52.01 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.88 HD21 HG21 ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 62.02 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 54.24 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.408 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 63.3 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 72.22 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.57 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 62.43 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 72.14 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.88 HG21 HD21 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 63.25 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.835 HG23 ' HE1' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 62.14 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.524 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.428 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 71.44 111.133 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 63.2 110.858 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 81' ' ' TYR . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 72.25 111.146 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.822 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.03 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 62.34 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.441 ' HA ' HD11 ' A' ' 129' ' ' ILE . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 53.21 110.858 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 51.1 110.862 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 71.12 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 64.34 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 25.35 112.539 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 71.15 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.12 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 63.01 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.686 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 65.03 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 70.44 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 43.43 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.067 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 61.34 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 71.24 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 64.51 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 71.25 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 54.51 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 63.11 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 63.5 110.918 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 64.42 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 64.12 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 62.03 110.925 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.31 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 73.32 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 142' ' ' GLU . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.799 ' O ' HD22 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 74.34 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.763 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 65.2 110.891 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.514 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 62.43 110.924 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 71.42 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.099 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.425 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.4 p . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.78 0.324 . . . . 73.54 111.149 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.425 ' N ' HG22 ' A' ' 13' ' ' VAL . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.794 HG21 HG21 ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 73.43 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.696 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 60.04 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 52.11 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.041 HD13 ' HB2' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 70.44 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.766 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 72.33 110.92 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.515 ' N ' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.861 0.363 . . . . 64.22 110.87 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.085 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.466 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 54.11 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 61.54 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.749 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 65.02 110.906 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.789 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.14 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 71.5 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.422 HG11 ' HG ' ' A' ' 117' ' ' LEU . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' OD2' ' A' ' 17' ' ' ASP . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.096 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.696 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 73.43 110.848 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.48 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.1 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.4 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.95 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.24 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.503 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 50.01 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 64.12 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.34 110.894 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 70.33 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.48 ' HG3' HD13 ' A' ' 55' ' ' LEU . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.753 HD21 HG21 ' A' ' 75' ' ' VAL . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 62.1 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.753 HG21 HD21 ' A' ' 67' ' ' LEU . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 50.32 111.111 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.749 HG23 ' HE1' ' A' ' 40' ' ' MET . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 64.12 111.109 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 64.12 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 73.23 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.32 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.505 HG22 ' N ' ' A' ' 83' ' ' HIS . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 54.13 111.065 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.505 ' N ' HG22 ' A' ' 82' ' ' VAL . 15.7 m80 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 63.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 73.01 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 71.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 82' ' ' VAL . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.2 111.106 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 51.2 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 71.44 112.381 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.766 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.41 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 64.35 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.545 ' CG ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 70.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.482 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 65.41 111.015 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 74.45 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 52.44 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 61.51 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 54.21 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.789 ' CE2' HG12 ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.33 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 51.12 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 62.15 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.482 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.495 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.898 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.545 HG22 ' CG ' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 45.43 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.794 HG21 HG21 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.041 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 64.23 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' PHE . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 32.42 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 65.22 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 61.13 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 62.25 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 70.43 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 63.45 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.693 HD13 ' N ' ' A' ' 141' ' ' LYS . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 62.31 110.984 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.693 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.33 110.924 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 62.01 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.845 0.355 . . . . 75.32 111.148 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 16' ' ' VAL . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.43 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.605 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.22 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.966 HD13 ' HB2' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 55.31 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.737 ' CD2' HD21 ' A' ' 92' ' ' LEU . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 64.03 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.21 110.804 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.847 0.356 . . . . 54.23 110.9 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.412 HD11 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 63.34 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.684 ' SD ' HD21 ' A' ' 117' ' ' LEU . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 53.4 110.878 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.864 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 64.54 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 63.33 110.964 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.408 ' CG ' HG13 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.439 HG11 HD13 ' A' ' 117' ' ' LEU . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 52.24 111.187 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 63.44 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 64.23 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 71.14 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 72.21 110.869 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 51' ' ' LEU . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.405 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.0 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 51.15 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.96 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 72.03 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.481 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 55.04 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.618 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 64.54 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 71.41 110.87 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.493 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.493 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 73.35 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 41.31 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.623 HG23 ' HE1' ' A' ' 40' ' ' MET . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 72.44 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.401 ' HB2' HD21 ' A' ' 140' ' ' LEU . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 88' ' ' VAL . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 24.2 m80 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 82' ' ' VAL . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.22 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.42 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.737 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.499 ' SG ' HD21 ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.588 ' HB2' HD13 ' A' ' 123' ' ' LEU . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 52.33 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 60.13 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 62.41 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.22 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.864 ' CE2' HG12 ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 50.01 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 61.34 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 64.3 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.59 HG11 HG21 ' A' ' 126' ' ' VAL . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 72.12 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.644 HG21 HG21 ' A' ' 16' ' ' VAL . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.966 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.476 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 94' ' ' PHE . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 52.21 110.964 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.59 HG21 HG11 ' A' ' 118' ' ' VAL . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 71.23 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 72.52 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 52.11 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 65.2 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.618 HD21 ' HB3' ' A' ' 63' ' ' LEU . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.461 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 71.32 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 64.32 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 63.51 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.575 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.127 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.7 t . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 72.43 111.149 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.13 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 63.45 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 60.13 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 61.2 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.664 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 64.14 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.475 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.066 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.768 0.318 . . . . 72.43 110.884 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 70.1 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.766 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.34 110.881 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.861 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 71.45 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 60.42 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 63.24 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.784 HD11 ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 42.1 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.4 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.784 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 52.52 110.912 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.406 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.24 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.406 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.3 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.961 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 62.03 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.492 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 73.32 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.492 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.898 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' HD13 ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.34 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.849 HD21 HG21 ' A' ' 75' ' ' VAL . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.437 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 62.21 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.437 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 63.35 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.403 ' CD2' HD22 ' A' ' 117' ' ' LEU . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.849 HG21 HD21 ' A' ' 67' ' ' LEU . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 60.01 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.766 HG23 ' HE1' ' A' ' 40' ' ' MET . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.507 ' HB2' HD12 ' A' ' 95' ' ' ILE . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.932 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 83' ' ' HIS . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.427 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.6 m80 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 71.0 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 74.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 123' ' ' LEU . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 72.52 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 77' ' ' TYR . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 73.22 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.446 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 52.14 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 62.34 110.898 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.03 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 71.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 52.42 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 72.34 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.861 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.534 ' O ' HG23 ' A' ' 118' ' ' VAL . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 62.14 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 65.4 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HG22 ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 114' ' ' LYS . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 70.3 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 64.13 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 72.55 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.066 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 50.31 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 94' ' ' PHE . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.918 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 55.04 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 71.15 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.14 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 54.24 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 52.42 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 73.24 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 65.2 110.954 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 71.33 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.474 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 142' ' ' GLU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.14 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.769 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.769 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.01 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 64.34 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 70.42 111.133 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.809 0.338 . . . . 74.3 111.136 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 1.026 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 54.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.949 HG21 HG21 ' A' ' 120' ' ' THR . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 73.22 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 72.22 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 65.4 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.08 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 55.1 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.719 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 62.25 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 73.44 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.429 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.816 0.341 . . . . 61.44 110.879 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 72.3 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 62.2 111.137 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.547 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 64.51 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.722 ' HG2' HD11 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 61.22 110.871 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 71.45 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.614 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 65.04 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 51.15 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 73.33 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.462 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 1.026 HG23 ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.462 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.633 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 61.34 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.547 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 HD13 ' HG3' ' A' ' 66' ' ' GLU . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 43.4 110.898 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.948 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 65.21 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 43.24 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 62.35 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.639 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 61.1 110.908 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 61.14 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG3' HD13 ' A' ' 55' ' ' LEU . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.867 HD21 HG21 ' A' ' 75' ' ' VAL . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 71.43 110.958 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 62.22 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 55.24 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.581 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.572 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.867 HG21 HD21 ' A' ' 67' ' ' LEU . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 53.13 111.171 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.695 HG23 ' HE1' ' A' ' 40' ' ' MET . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 70.24 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.591 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.574 ' N ' HG12 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 71.21 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.13 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 72.52 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.719 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 64.42 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.852 ' HB2' HD13 ' A' ' 123' ' ' LEU . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 64.01 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.24 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 52.54 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 55.21 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 55.2 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.614 ' CE2' HG12 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.117 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 34.22 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 61.31 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 64.11 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 HG11 ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.531 HG22 ' CG ' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 64.41 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.949 HG21 HG21 ' A' ' 16' ' ' VAL . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 55.42 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.08 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.437 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.852 HD13 ' HB2' ' A' ' 94' ' ' PHE . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.734 HG13 ' HD2' ' A' ' 94' ' ' PHE . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.567 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.582 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 63.03 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 63.51 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 74.21 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 61.13 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.582 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.639 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 65.21 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 71.35 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 73.2 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.591 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.567 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 140' ' ' LEU . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 72.31 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.1 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.835 0.35 . . . . 73.31 111.177 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 41.43 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.915 HG21 HG21 ' A' ' 120' ' ' THR . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 45.02 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 64.41 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.703 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.24 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.107 HD13 ' HB2' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 50.33 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 64.51 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.21 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 72.25 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.4 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.464 ' N ' ' ND2' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.851 0.358 . . . . 65.53 110.877 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 70.34 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 64.31 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.476 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 74.41 111.131 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 60.3 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.758 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.756 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 70.34 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 35.05 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 73.12 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.14 110.905 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.975 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 71.43 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.501 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.501 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.53 ' O ' HD13 ' A' ' 65' ' ' LEU . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 42.31 110.897 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 63.42 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.674 HD21 HG21 ' A' ' 75' ' ' VAL . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 51.23 110.91 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.481 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 55.25 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.554 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 42.21 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 70.13 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.674 HG21 HD21 ' A' ' 67' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.32 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.758 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.496 HG12 ' N ' ' A' ' 83' ' ' HIS . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 61.21 111.154 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.496 ' N ' HG12 ' A' ' 82' ' ' VAL . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 70.04 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 44.11 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.24 112.345 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.938 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.658 ' HB2' HD13 ' A' ' 123' ' ' LEU . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 70.44 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 71.12 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 52.31 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 72.41 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 50.35 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.756 ' CE2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 71.45 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 71.32 112.494 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 54.14 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 52.22 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.633 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.549 HG22 ' CG ' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.915 HG21 HG21 ' A' ' 16' ' ' VAL . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 61.24 111.155 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.107 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 51.21 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.438 HG23 ' HG3' ' A' ' 125' ' ' LYS . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.438 ' HG3' HG23 ' A' ' 124' ' ' THR . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' A' ' 94' ' ' PHE . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 62.4 111.104 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 72.42 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 71.23 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 63.02 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 72.24 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 62.25 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.55 HG22 ' HG3' ' A' ' 142' ' ' GLU . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 62.43 111.136 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 61.24 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.796 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 60.13 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.55 ' HG3' HG22 ' A' ' 138' ' ' THR . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 61.54 110.821 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.585 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.777 0.322 . . . . 70.45 111.178 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 45.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 71.15 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.03 HG21 HG21 ' A' ' 120' ' ' THR . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 73.44 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 51' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.13 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.54 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 72.11 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 72.53 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.776 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.55 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 65.12 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.795 0.331 . . . . 62.34 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.473 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.746 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 64.33 110.864 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.831 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 72.2 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.406 ' CG ' ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HG3' ' CG ' ' A' ' 45' ' ' ASP . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 72.11 110.885 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 62.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.448 HG11 HD23 ' A' ' 117' ' ' LEU . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 52.01 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.735 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.425 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 53.21 110.91 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.05 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.963 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 73.45 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 61.23 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 61.53 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.644 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 64.2 110.934 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 72.13 110.894 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.758 HD21 HG21 ' A' ' 75' ' ' VAL . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.419 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 54.51 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.456 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.758 HG21 HD21 ' A' ' 67' ' ' LEU . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 64.14 111.106 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.746 HG23 ' CE ' ' A' ' 40' ' ' MET . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.49 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 72.43 110.936 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.546 ' HB2' HD21 ' A' ' 140' ' ' LEU . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.23 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 64.42 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.523 ' N ' HG12 ' A' ' 82' ' ' VAL . 35.4 m80 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 73.23 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 53.11 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.41 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.776 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 52.42 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 60.44 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.612 ' CG ' HG22 ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.49 HD12 ' HB2' ' A' ' 77' ' ' TYR . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 65.44 111.116 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.574 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 52.22 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.12 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.419 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 73.2 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.3 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.831 ' CE2' HG12 ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.574 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.472 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 53.4 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 71.54 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' THR . . . . . 1.03 HG21 HG21 ' A' ' 16' ' ' VAL . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 54.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 62.52 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 94' ' ' PHE . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 63.32 110.965 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 52.15 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 71.01 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.61 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 63.24 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 52.04 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.644 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 61.32 110.85 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 45.2 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 63.05 110.853 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 64.11 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.628 HD13 ' HG2' ' A' ' 91' ' ' PRO . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.824 0.345 . . . . 52.31 111.174 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.06 HG21 HG21 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.45 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 64.52 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.493 ' O ' HD23 ' A' ' 20' ' ' LEU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 51.55 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 63.12 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.98 HD13 ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 61.11 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 72.44 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 43.04 110.926 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 120.805 0.336 . . . . 75.41 110.901 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 62.15 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.506 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 61.23 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.45 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG23 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 62.35 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.02 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.88 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 63.25 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 63.4 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 117' ' ' LEU . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.425 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 52.33 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 65.12 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 54.33 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.698 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 64.14 110.838 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.444 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.2 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.981 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.49 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.685 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 74.32 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.12 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.657 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 73.5 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.523 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 73.32 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.431 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 64.33 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.431 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 62.53 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 1.043 HG21 HD21 ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 45.4 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 76' ' ' VAL . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 61.31 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 73.53 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 72.21 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 72.31 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 51.45 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 81' ' ' TYR . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.508 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.05 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 61.33 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.72 ' CE1' HD12 ' A' ' 117' ' ' LEU . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 62.44 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.441 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 61.04 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 62.25 110.875 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.416 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 53.35 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 60.34 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 71.21 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 74.53 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 71.53 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.88 ' CE2' HG12 ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 55.03 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.72 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.688 HG22 ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 73.33 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 61.52 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' THR . . . . . 1.06 HG21 HG21 ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 63.11 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.98 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.575 HD13 ' HB2' ' A' ' 94' ' ' PHE . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.858 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.638 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.109 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 71.35 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.592 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 71.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.596 HG23 ' OD1' ' A' ' 134' ' ' ASP . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 60.45 111.126 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.04 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 53.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.596 ' OD1' HG23 ' A' ' 131' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.685 HD22 ' O ' ' A' ' 60' ' ' PRO . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 71.3 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.592 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.767 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.767 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 62.02 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.454 HD13 ' HG2' ' A' ' 91' ' ' PRO . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 55.43 111.12 179.787 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.813 0.339 . . . . 51.2 111.125 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 53.3 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 72.32 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 70.3 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 63.51 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 70.4 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.772 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 72.23 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.83 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.472 ' N ' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.036 0 CA-C-O 120.788 0.327 . . . . 74.1 110.875 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 61.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 60.34 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.589 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 62.32 111.101 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.776 ' CE ' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.76 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 65.52 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 71.52 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.418 HG11 HD13 ' A' ' 117' ' ' LEU . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 54.04 111.14 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.401 HG12 ' OD2' ' A' ' 17' ' ' ASP . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.472 HD13 ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 70.35 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.434 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 63.4 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.434 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.951 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.633 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 70.01 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 65.42 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.413 ' CD2' HG21 ' A' ' 75' ' ' VAL . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.479 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 52.22 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' PRO . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 64.12 110.991 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.424 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.479 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CD2' HD22 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 67' ' ' LEU . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.211 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.776 HG23 ' CE ' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.587 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.02 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.452 HG13 ' HB ' ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 62.21 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 74.42 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 55.42 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.452 ' HB ' HG13 ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.496 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.772 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 70.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.5 ' SG ' HD21 ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 71.23 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.32 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 71.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 61.55 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 70.22 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.76 ' CE2' HG12 ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 61.41 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 54.53 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.3 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.559 HD22 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 74.55 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.439 HG22 ' CD1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.718 HG21 HG21 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 71.31 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 52.55 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 64.4 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.23 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.633 HD21 ' HB3' ' A' ' 63' ' ' LEU . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.22 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 62.14 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 79' ' ' TYR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 71.42 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 72.52 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 64.33 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 61.13 111.089 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.824 0.345 . . . . 41.42 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.803 HG21 HG21 ' A' ' 120' ' ' THR . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 63.23 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.13 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 44.53 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 62.44 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 71.41 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.085 HD13 ' HB2' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 63.34 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 71.41 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 53.51 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.8 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.841 0.353 . . . . 72.1 110.9 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.831 HG23 ' CG ' ' A' ' 54' ' ' GLU . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.42 HG12 HG22 ' A' ' 75' ' ' VAL . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.678 ' HE1' HG23 ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.2 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 73.33 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.847 HG11 HD13 ' A' ' 117' ' ' LEU . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 65.31 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 62.34 110.919 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.413 ' CG ' ' O ' ' A' ' 52' ' ' GLU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.831 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.559 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 65.55 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.495 ' O ' HG22 ' A' ' 58' ' ' ILE . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.984 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 71.54 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.685 ' O ' HD13 ' A' ' 65' ' ' LEU . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.53 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HG2' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 61' ' ' GLU . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.559 ' HG3' HD13 ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 1.008 HD21 HG21 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.501 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 61.54 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.583 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 53.44 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.902 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.491 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.2 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 1.008 HG21 HD21 ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 51.52 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.678 HG23 ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.451 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.722 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 62.11 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.566 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 64.04 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.433 HG21 ' HE2' ' A' ' 80' ' ' LYS . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 63.01 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.561 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 44.33 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.413 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.8 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 71.14 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.506 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 55.11 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.581 ' HD2' HG23 ' A' ' 126' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 70.42 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.484 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 64.11 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.599 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 72.05 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.23 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.33 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 63.01 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 61.13 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 44.34 112.458 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.591 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.12 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.52 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 49' ' ' VAL . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 114' ' ' LYS . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 73.41 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.803 HG21 HG21 ' A' ' 16' ' ' VAL . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 64.13 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.085 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 52.42 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.581 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 73.23 111.121 179.906 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 63.22 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.534 HG22 ' HB3' ' A' ' 134' ' ' ASP . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.54 111.134 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 65.54 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.52 HG23 HH22 ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.534 ' HB3' HG22 ' A' ' 129' ' ' ILE . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 50.02 110.884 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.419 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' A' ' 79' ' ' TYR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 71.13 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.538 HD11 HD11 ' A' ' 140' ' ' LEU . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.759 0.314 . . . . 75.41 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 HG21 ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 32.42 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.492 ' OD2' HG12 ' A' ' 50' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.51 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 61.13 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.01 HD13 ' HB2' ' A' ' 121' ' ' ALA . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 64.53 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 71.42 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.45 ' ND2' HH21 ' A' ' 30' ' ' ARG . 6.9 p30 . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.852 0.358 . . . . 53.23 110.89 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 54.45 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 35.05 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.616 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 HG22 ' A' ' 75' ' ' VAL . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 64.42 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.838 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 52.14 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 52.3 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.4 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.25 110.894 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.879 HG11 HD13 ' A' ' 117' ' ' LEU . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' OD2' ' A' ' 17' ' ' ASP . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 71.32 111.144 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 64.42 110.896 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.412 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 72.42 110.975 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.0 m120 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 63.33 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.928 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.644 ' O ' HD13 ' A' ' 65' ' ' LEU . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 55' ' ' LEU . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.781 HD21 HG21 ' A' ' 75' ' ' VAL . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 70.33 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.452 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 53.42 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.579 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.452 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.658 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.781 HG21 HD21 ' A' ' 67' ' ' LEU . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.405 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.906 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 61.43 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 65.34 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.455 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 72.52 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 72.23 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.404 ' HB ' HG13 ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.15 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.602 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.473 ' HB2' HD13 ' A' ' 123' ' ' LEU . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 62.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.439 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 52.13 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 71.34 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 65.13 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 70.22 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.838 ' CE2' HG12 ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 71.4 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 72.03 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 73.45 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.879 HD13 HG11 ' A' ' 49' ' ' VAL . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.24 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.903 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 54.02 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.01 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 65.2 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 62.42 110.936 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 72.21 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 65.42 110.952 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.558 HG22 ' HG3' ' A' ' 142' ' ' GLU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.23 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.642 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.642 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 71.21 110.891 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.558 ' HG3' HG22 ' A' ' 138' ' ' THR . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 63.42 110.886 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 62.42 111.043 179.813 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.83 0.348 . . . . 61.11 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.99 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.816 HG11 HG21 ' A' ' 120' ' ' THR . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 70.0 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 40' ' ' MET . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.35 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 71.03 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.007 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 62.41 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.738 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.458 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 64.44 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 64.13 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 64.1 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.486 ' N ' ' ND2' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.867 0.365 . . . . 73.22 110.865 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 60.22 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 53.15 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 53.3 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.433 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 71.53 111.155 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.79 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.945 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 62.13 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.725 ' NH2' HG21 ' A' ' 50' ' ' VAL . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 61.13 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 48' ' ' MET . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 72.52 110.905 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.99 HG23 ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.725 HG21 ' NH2' ' A' ' 46' ' ' ARG . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.734 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.437 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 73.2 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.406 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.406 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.986 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.563 ' O ' HD13 ' A' ' 65' ' ' LEU . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 60.14 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.692 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 72.22 110.974 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 61' ' ' GLU . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.11 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.66 HD21 HG21 ' A' ' 75' ' ' VAL . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 63.24 110.874 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.485 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 51.45 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 72.43 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.485 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.66 HG21 HD21 ' A' ' 67' ' ' LEU . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 65.34 111.175 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.79 HG23 ' CE ' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.565 ' HB2' HD12 ' A' ' 95' ' ' ILE . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.547 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 50.11 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.667 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.513 HG13 ' HB ' ' A' ' 88' ' ' VAL . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 53.5 111.207 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.422 ' N ' HG12 ' A' ' 82' ' ' VAL . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 60.14 110.899 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 52.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 44.12 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 81' ' ' TYR . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 54.44 111.158 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 62.1 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.547 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 72.24 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.738 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 54.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.565 ' CZ ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 64.44 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.565 HD12 ' HB2' ' A' ' 77' ' ' TYR . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.23 111.133 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.496 ' HA ' HD11 ' A' ' 129' ' ' ILE . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.14 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 73.35 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 73.35 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 62.44 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.33 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.434 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.945 ' CE2' HG12 ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 62.23 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.751 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.565 HG22 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.816 HG21 HG11 ' A' ' 16' ' ' VAL . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.007 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.51 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' THR . . . . . 0.538 HG23 ' HG2' ' A' ' 125' ' ' LYS . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 62.24 111.116 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' A' ' 124' ' ' THR . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 HG11 ' A' ' 118' ' ' VAL . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 73.23 111.147 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.02 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.594 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 52.15 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 71.43 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.692 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.528 HG22 ' HG3' ' A' ' 142' ' ' GLU . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 61.1 111.148 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.72 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.72 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.528 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 62.42 110.924 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 71.43 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 23.53 111.14 179.744 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.874 0.369 . . . . 74.45 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.05 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 70.03 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.726 HG21 HG21 ' A' ' 120' ' ' THR . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 53.31 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.487 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 72.31 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 62.2 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.842 0.353 . . . . 65.31 110.859 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 55.35 111.072 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.484 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 60.5 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 ' CG ' ' A' ' 54' ' ' GLU . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.569 HG23 ' HG3' ' A' ' 73' ' ' ARG . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 64.11 111.145 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.535 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 51.21 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.883 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 70.33 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 43.21 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.667 HG11 HD13 ' A' ' 117' ' ' LEU . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.487 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 62.24 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 20' ' ' LEU . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.635 ' N ' HD23 ' A' ' 51' ' ' LEU . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.465 ' N ' HD23 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.409 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.519 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 52.03 110.952 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.991 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 71.05 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.512 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.512 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' HD23 ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 61.21 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 72.32 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.736 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.558 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 55' ' ' LEU . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.888 HD22 ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 63.11 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.486 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.423 ' HB2' ' NH1' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' NH1' ' HB2' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' PRO . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 55.05 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.888 ' NH1' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 73.0 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.623 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 61.43 111.117 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.535 HG23 ' HE1' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 63.34 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.641 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 70.12 111.13 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 27.0 m80 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 34.41 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.13 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.641 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 64.41 111.143 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 63.45 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 45.54 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.514 ' CG ' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 61.11 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.558 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.449 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 62.15 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 63.23 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 71.43 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 64.24 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 53.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 73.41 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.413 ' N ' ' O ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 70.12 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.883 ' CE2' HG12 ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 65.13 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 63.24 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.558 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.667 HD13 HG11 ' A' ' 49' ' ' VAL . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.514 HG22 ' CG ' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 44.31 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.726 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 65.14 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 62.41 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 54.41 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 64.45 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 70.25 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.489 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 64.44 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.736 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 71.3 110.939 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 64.24 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 61.01 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 70.11 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.34 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.573 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 54.14 111.107 179.812 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.888 0.375 . . . . 72.51 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.0 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 52.31 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 62.4 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.784 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 51' ' ' LEU . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.942 HD13 ' HB2' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.744 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 65.11 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 71.15 110.882 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.807 0.337 . . . . 74.51 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 64.05 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.4 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.516 HG23 ' HG3' ' A' ' 73' ' ' ARG . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 71.4 111.142 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.786 ' CE ' HG23 ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 64.5 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.778 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 72.31 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 73.33 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 71.3 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 51.34 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 52.33 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HB3' HG22 ' A' ' 39' ' ' ILE . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 51.45 110.864 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 62.54 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' HG22 ' A' ' 58' ' ' ILE . 3.4 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.03 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.93 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.02 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.502 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.502 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.633 ' O ' HD23 ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.929 179.843 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.633 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 54.21 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.765 HD13 HH12 ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.13 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.487 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.416 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.765 HH12 HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.5 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 117' ' ' LEU . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 43.23 111.154 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.786 HG23 ' CE ' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 60.24 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 60.45 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 72.04 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 83' ' ' HIS . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 72.34 111.168 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.475 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 41.21 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 65.12 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.744 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.627 ' CD1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 65.12 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.56 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.429 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 41.22 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.416 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 62.24 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 65.04 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.778 ' CE2' HG12 ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 65.25 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.603 HD21 ' SD ' ' A' ' 40' ' ' MET . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.627 HG22 ' CD1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 65.52 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.4 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.942 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 71.51 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.479 HD13 ' CD1' ' A' ' 94' ' ' PHE . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 54.51 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.494 HG22 HG11 ' A' ' 118' ' ' VAL . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.4 111.105 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 63.53 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.14 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.415 ' O ' HG23 ' A' ' 136' ' ' THR . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.56 HD12 ' C ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 65.44 110.929 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 50.21 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.464 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 62.51 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 70.54 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 55.32 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 44.32 111.155 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.851 0.358 . . . . 61.0 111.133 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.873 HG21 HG21 ' A' ' 120' ' ' THR . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 61.51 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.517 ' CG ' HG12 ' A' ' 50' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.23 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 40.25 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.663 HD21 HD21 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 51' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 55.12 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.977 HD13 ' HB2' ' A' ' 121' ' ' ALA . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.636 ' CD1' HD11 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 61.1 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 65.14 110.867 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.85 0.357 . . . . 74.02 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.766 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 53.41 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.636 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.505 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 71.11 111.078 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.714 HG12 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 64.22 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.41 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 73.42 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.631 HG11 HD13 ' A' ' 117' ' ' LEU . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.517 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.414 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 71.5 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.526 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 64.24 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 73.3 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.612 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.766 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 61.3 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 61' ' ' GLU . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HG3' HD13 ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.932 HD22 ' HE ' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 70.54 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 71.21 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 63.13 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.932 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.46 ' CD2' HD22 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 73.11 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.779 HG21 HD21 ' A' ' 67' ' ' LEU . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 61.52 111.097 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 70.11 111.145 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.57 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 61.33 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.34 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.41 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.01 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.52 ' HB2' HD22 ' A' ' 144' ' ' LEU . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.634 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.564 ' SG ' HD21 ' A' ' 144' ' ' LEU . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.852 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.761 ' HB2' HD13 ' A' ' 123' ' ' LEU . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.41 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.456 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 41.41 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 63.41 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 64.41 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 61.44 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.714 ' CE2' HG12 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 72.32 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 52.05 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.62 ' O ' HG23 ' A' ' 118' ' ' VAL . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.412 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.631 HD13 HG11 ' A' ' 49' ' ' VAL . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 73.15 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 114' ' ' LYS . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.873 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 64.2 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.977 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.761 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 71.14 110.915 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 74.24 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 60.42 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.34 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.1 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.483 HG23 HH22 ' A' ' 73' ' ' ARG . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.661 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 63.04 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 45.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 79' ' ' TYR . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 71.13 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.564 HD21 ' SG ' ' A' ' 93' ' ' CYS . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.807 0.337 . . . . 73.25 111.092 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 64.53 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.049 HG21 HG21 ' A' ' 120' ' ' THR . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.533 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.682 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 61.11 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.061 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 65.41 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 72.44 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p30 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.36 . . . . 65.03 110.902 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 41.23 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 63.54 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.699 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.882 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.468 HG23 HG22 ' A' ' 75' ' ' VAL . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 54.41 111.099 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.812 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.1 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.844 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 41.53 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 63.13 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.33 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.533 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 53.32 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.682 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.486 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.586 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 54.21 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' ILE . 2.6 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 71.11 110.889 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.97 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 70.03 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.699 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 71.43 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.586 ' HG3' HD13 ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 41.32 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.491 HD13 ' OG ' ' A' ' 97' ' ' SER . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 63.33 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.485 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 42.11 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.581 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.515 HH22 HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 71.22 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.468 HG22 HG23 ' A' ' 39' ' ' ILE . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 61.14 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.812 HG23 ' CE ' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.436 ' HD2' HD22 ' A' ' 140' ' ' LEU . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.594 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 70.24 110.914 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.505 ' CE ' HG21 ' A' ' 88' ' ' VAL . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 55.31 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' N ' ' A' ' 83' ' ' HIS . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.576 ' N ' HG12 ' A' ' 82' ' ' VAL . 46.8 m80 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 42.23 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 74.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.505 HG21 ' CE ' ' A' ' 80' ' ' LYS . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 73.51 111.089 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.2 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 53.23 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.471 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.12 112.318 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.705 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.25 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 51.41 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.791 ' HB2' HD13 ' A' ' 123' ' ' LEU . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 62.35 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.124 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.602 ' OG ' HD11 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 51.13 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' CYS . . . . . 0.442 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 74.24 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 73.32 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 62.23 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 44.13 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 72.15 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.844 ' CE2' HG12 ' A' ' 42' ' ' VAL . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 71.33 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 61.14 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 65.45 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 70.45 110.931 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.657 HG22 ' CD2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' THR . . . . . 1.049 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 72.31 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.061 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 71.2 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 64.22 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 43.42 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.697 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 71.54 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.23 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 HH22 ' A' ' 73' ' ' ARG . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 53.3 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 135' ' ' LEU . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 61.25 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.33 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.594 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' A' ' 91' ' ' PRO . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 71.24 111.125 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.812 0.339 . . . . 53.22 111.114 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 1.01 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.948 HG21 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 41.51 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 53.15 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.783 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 54.22 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 61.53 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 64.15 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 62.33 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.127 HD13 ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.4 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.33 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 71.3 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.768 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.554 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.914 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.441 ' O ' ' NH2' ' A' ' 30' ' ' ARG . 13.1 p30 . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.81 0.338 . . . . 63.42 110.931 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 41.2 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.776 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.519 HG23 HG22 ' A' ' 75' ' ' VAL . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 61.41 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.783 ' HG2' HD11 ' A' ' 20' ' ' LEU . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 41.34 110.86 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.89 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 52.45 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 71.15 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.535 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 1.01 HG23 ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 42.43 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.416 HG12 ' CG ' ' A' ' 17' ' ' ASP . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 73.24 111.136 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.662 ' N ' HD12 ' A' ' 20' ' ' LEU . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 63.1 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.776 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 64.53 110.913 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m120 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.885 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.01 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.476 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.476 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.2 110.796 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 73.23 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.566 HD21 HG21 ' A' ' 75' ' ' VAL . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 74.25 110.892 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 70.52 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PHE . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.566 HG21 HD21 ' A' ' 67' ' ' LEU . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.43 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.626 HG23 ' HE1' ' A' ' 40' ' ' MET . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 74.4 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.486 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 62.23 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.631 ' HB2' HD21 ' A' ' 140' ' ' LEU . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.44 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 63.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 83' ' ' HIS . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.438 ' N ' HG12 ' A' ' 82' ' ' VAL . 13.8 m80 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 72.34 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 64.14 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.647 ' CG ' HD13 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 71.22 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' CYS . . . . . 0.438 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' PHE . . . . . 0.63 ' CE1' HD12 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 72.33 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 51.34 111.12 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 50.14 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.44 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 61.35 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 65.35 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 63.41 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 65.03 110.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.535 ' HE1' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 70.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.89 ' CE2' HG12 ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 43.34 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 70.33 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.0 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.63 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.601 HG22 ' CG ' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.0 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 63.15 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.948 ' CG2' HG21 ' A' ' 16' ' ' VAL . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 1.127 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 61.33 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.469 HD13 ' HB2' ' A' ' 94' ' ' PHE . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.45 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 71.4 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.627 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 61.53 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.515 HG22 ' HB3' ' A' ' 134' ' ' ASP . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 64.45 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 42.01 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 71.3 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ASP . . . . . 0.515 ' HB3' HG22 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' TRP . . . . . 0.54 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.631 HD21 ' HB2' ' A' ' 79' ' ' TYR . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.14 110.92 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 65.52 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.54 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 63.21 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 144' ' ' LEU . . . . . 0.647 HD13 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.3 111.118 179.858 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.511 -0.236 . . . . 73.5 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.96 -45.34 6.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 52.3 110.843 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -50.17 114.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 73.1 110.844 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 167.63 11.26 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.753 -0.737 . . . . 75.34 112.462 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 153.49 47.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 74.4 110.866 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 p -146.55 173.17 12.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 64.14 110.891 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.34 -91.64 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.734 -0.746 . . . . 54.51 112.506 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -84.96 159.05 20.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 52.12 110.844 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.58 81.58 1.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 63.42 110.877 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.7 m -174.32 138.91 0.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 73.04 110.871 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mt -133.01 -175.16 3.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 71.04 110.928 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.65 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.7 p -96.83 44.82 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 74.42 111.173 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -38.73 139.37 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 70.5 111.172 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.927 HG21 ' CG2' ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 72.44 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 65.52 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.41 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.142 HD13 ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 71.44 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 64.42 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.843 ' CD1' HD11 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 73.03 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.585 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -73.63 165.63 24.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 72.45 110.854 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.69 33.67 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 63.35 110.888 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 23.4 mt-10 -113.89 175.25 5.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 74.34 110.839 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.4 p -148.19 26.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 73.54 111.102 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -126.13 -176.69 3.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 65.44 110.904 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 52.31 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 51.52 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.843 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 71.3 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.472 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.75 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 55.52 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 62.42 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.833 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 64.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 64.24 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 54.51 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.457 HG11 HD23 ' A' ' 117' ' ' LEU . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 73.43 111.109 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.463 ' C ' HD12 ' A' ' 20' ' ' LEU . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 65.34 111.144 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.62 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.04 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.809 ' HG3' HG23 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.452 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 62.33 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.983 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 72.11 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' HD23 ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.575 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 71.41 110.915 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.604 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 52.22 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.452 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 51.21 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.947 HD21 HG21 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.12 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 114' ' ' LYS . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 HD21 ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.75 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.33 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 61.12 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.04 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.605 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 64.22 111.162 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG22 ' A' ' 82' ' ' VAL . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.23 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 63.31 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.605 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 50.01 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 61.31 110.894 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.906 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 73.1 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 71.44 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 43.21 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 34.5 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 52.23 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 72.0 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 61.2 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 62.54 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.532 ' HG2' HG11 ' A' ' 12' ' ' VAL . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 52.04 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.833 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.04 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 71.22 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.417 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.13 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.927 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.142 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 94' ' ' PHE . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.915 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 72.11 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 64.21 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 71.13 111.146 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.583 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.34 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 35.21 110.954 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 71.34 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 53.34 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.417 HG22 ' HG3' ' A' ' 142' ' ' GLU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.73 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.04 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.73 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 50.1 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.417 ' HG3' HG22 ' A' ' 138' ' ' THR . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.583 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.03 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 65.0 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -37.95 -72.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.43 76.08 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 72.42 110.858 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 61.42 145.72 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 51.33 112.47 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -168.69 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.67 2.247 . . . . 61.05 112.348 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.37 112.75 25.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.858 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.3 m 57.7 166.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 71.23 110.883 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 41.34 112.486 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 112.507 -0.237 . . . . 65.54 112.507 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -121.1 -50.3 2.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 73.44 110.842 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.8 t -174.91 -56.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 75.43 110.877 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.25 -144.74 39.8 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.705 -0.759 . . . . 71.41 112.476 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -134.1 -64.05 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.867 0.365 . . . . 74.11 110.826 -179.763 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.1 OUTLIER 79.21 -55.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 72.12 110.88 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.22 -84.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 61.03 112.568 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.8 131.5 51.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 72.22 110.834 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.56 86.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.495 . . . . 72.43 110.889 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 61.3 m -88.02 129.8 35.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.836 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mt -137.4 179.1 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 73.44 110.815 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 12' ' ' VAL . 11.0 p -105.27 44.65 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 71.5 111.123 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.422 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.5 p -37.88 153.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.445 . . . . 71.31 111.106 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' N ' HG22 ' A' ' 13' ' ' VAL . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.885 HG21 HG21 ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.2 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 65.43 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 70.42 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 40' ' ' MET . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 73.3 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 63.53 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.23 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 71.32 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CD2' HD21 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 33.21 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 70.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -72.81 162.64 29.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -90.99 20.64 4.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 73.4 110.866 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 3.2 mp0 -100.51 179.34 4.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 60.41 110.9 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.8 p -151.57 26.54 0.66 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 73.43 111.155 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -127.02 -178.17 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 71.14 110.848 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 63.1 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 64.14 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 72.25 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.81 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.53 110.861 179.894 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.759 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 64.43 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 62.42 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 41.11 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 54' ' ' GLU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.1 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.729 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.456 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.965 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 63.35 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 53.53 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 64.42 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.685 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 65.22 110.891 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.456 ' HG3' HD13 ' A' ' 55' ' ' LEU . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.12 110.901 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 43.12 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 63.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.424 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.572 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.612 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 65.12 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.81 HG23 ' HE1' ' A' ' 40' ' ' MET . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.05 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 71.01 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.507 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.751 HG23 ' HB ' ' A' ' 88' ' ' VAL . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 53.53 111.152 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.436 ' H ' HG22 ' A' ' 82' ' ' VAL . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 61.34 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.751 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.21 111.113 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 64.0 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 72.43 110.882 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.468 ' HB2' HD22 ' A' ' 144' ' ' LEU . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.773 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.11 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.414 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 74.13 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 61.32 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 70.21 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 73.53 112.314 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 52.45 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 71.1 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.759 ' CE2' HG12 ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 45.04 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 45.24 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.628 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 63.53 110.893 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 64.1 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 63.1 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.724 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 70.32 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 114' ' ' LYS . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.885 HG21 HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 61.44 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 73.41 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.402 HG13 ' HD2' ' A' ' 94' ' ' PHE . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.526 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 71.33 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 62.43 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.452 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.23 110.927 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 62.51 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 142' ' ' GLU . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.89 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.89 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.15 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.51 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.468 HD22 ' HB2' ' A' ' 91' ' ' PRO . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -52.13 178.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 56.8 p -100.42 43.36 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 52.45 110.812 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 66.99 151.72 0.19 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 71.21 112.495 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -174.85 0.97 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 74.54 112.386 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.22 125.7 37.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 64.01 110.906 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 12.5 t -85.85 122.12 29.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.827 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.666 -0.778 . . . . 63.35 112.464 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.469 -0.252 . . . . 74.41 112.469 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -152.57 121.35 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.873 0.368 . . . . 70.52 110.878 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 66.41 123.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 73.51 110.906 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.433 ' O ' ' C ' ' A' ' 5' ' ' SER . . . 126.56 -46.26 1.1 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.706 -0.759 . . . . 63.23 112.434 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -35.83 121.0 0.63 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.848 0.356 . . . . 65.04 110.859 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 p -147.82 -52.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.862 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.0 -37.8 3.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.727 -0.749 . . . . 51.25 112.521 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.7 83.93 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.93 0.395 . . . . 72.21 110.896 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -173.09 76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 55.21 110.817 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 p 51.9 174.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 43.14 110.871 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mt -143.97 -173.82 4.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 40.41 110.892 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 12' ' ' VAL . 9.2 p -103.5 44.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 53.42 111.112 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -40.92 140.66 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 65.14 111.161 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 63.11 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 62.12 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.493 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.11 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.473 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.9 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 55.14 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.781 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 73.32 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -70.04 162.69 27.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -85.84 30.3 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 55.13 110.871 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 22.2 mm-40 -114.39 177.11 4.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.875 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 p -149.73 30.43 0.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 62.24 111.184 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -129.64 175.31 8.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 65.33 110.917 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.44 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.874 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.543 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.685 HG21 ' CZ ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.674 ' CE ' HG23 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.776 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 71.52 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.881 HG11 HD13 ' A' ' 117' ' ' LEU . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.816 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 65.32 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.55 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.816 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.454 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.937 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.499 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 61.42 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.894 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.874 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 62.45 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.73 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.13 110.83 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.73 HD22 ' HG2' ' A' ' 64' ' ' LYS . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.872 HD21 HG21 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 44.53 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.02 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.451 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 52.1 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.56 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 31.21 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.685 ' CZ ' HG21 ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.872 HG21 HD21 ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 73.45 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.674 HG23 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.45 ' HD1' ' HB2' ' A' ' 37' ' ' ALA . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 53.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 63.43 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 74.3 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 72.32 111.154 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.9 m80 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.828 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 51.4 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 60.53 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 88' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 55.1 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.781 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 144' ' ' LEU . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.755 ' CD1' HG22 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 77' ' ' TYR . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 63.55 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 53.13 110.892 -179.801 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 55.04 112.312 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.451 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 61.12 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.776 ' CE2' HG12 ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 71.22 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 61.12 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 72.4 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 70.11 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 118' ' ' VAL . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.03 110.847 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 55.43 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.881 HD13 HG11 ' A' ' 49' ' ' VAL . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.755 HG22 ' CD1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 64.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.71 HG21 HG21 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.9 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 52.15 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 94' ' ' PHE . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 62.02 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.0 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.567 ' CG2' HG11 ' A' ' 118' ' ' VAL . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.464 ' HE2' ' HG ' ' A' ' 93' ' ' CYS . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.401 HG22 ' HB3' ' A' ' 134' ' ' ASP . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 63.52 111.067 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.5 HG22 ' HB2' ' A' ' 67' ' ' LEU . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.894 HD22 ' O ' ' A' ' 60' ' ' PRO . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 50.5 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 70.41 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 93' ' ' CYS . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.58 -69.24 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.43 111.099 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.9 t -170.89 32.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.852 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.41 163.56 17.75 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 61.24 112.485 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 179.19 3.88 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.655 2.237 . . . . 54.24 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 30.4 t -67.45 -61.48 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 75.04 110.819 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 76.2 p -147.18 172.79 13.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 73.51 110.837 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.768 -0.729 . . . . 53.33 112.51 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.536 -0.226 . . . . 54.04 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -164.64 116.55 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.353 . . . . 55.24 110.972 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.12 90.93 8.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 64.41 110.814 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.54 166.57 12.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 72.13 112.451 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -178.59 -44.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.833 0.349 . . . . 73.2 110.848 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 t -76.85 -53.59 7.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 75.31 110.855 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 143.95 -155.51 26.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.767 -0.73 . . . . 50.51 112.476 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.02 -41.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 70.35 110.845 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -128.59 -141.47 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.839 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.8 p -108.81 151.73 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 64.23 110.891 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD13 ' CA ' ' A' ' 112' ' ' GLY . 3.0 mt -143.88 -172.99 3.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.183 -0.462 . . . . 63.24 110.946 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -94.57 43.02 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.33 111.156 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.8 p -36.02 125.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 73.23 111.179 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 55.13 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 50.41 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 60.43 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.559 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.067 HD13 ' HB2' ' A' ' 121' ' ' ALA . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.822 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 53.23 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.0 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -71.61 165.04 24.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.87 35.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 51.22 110.903 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 14.9 mt-10 -115.35 171.86 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 72.32 110.877 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.5 p -145.22 19.19 1.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.202 -0.454 . . . . 44.42 111.145 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -119.19 -179.1 3.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 64.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 53.25 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 71.14 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 ' CG ' ' A' ' 54' ' ' GLU . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.576 ' CG1' HG22 ' A' ' 75' ' ' VAL . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 63.41 111.101 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.835 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.8 OUTLIER 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 50.45 110.928 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.35 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.789 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.789 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 72.15 110.896 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.33 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.456 ' O ' HG22 ' A' ' 58' ' ' ILE . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 62.54 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.955 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.491 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 65.53 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 52.03 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.405 ' OE2' HD12 ' A' ' 65' ' ' LEU . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 73.52 110.858 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.632 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 71.2 110.875 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.405 HD12 ' OE2' ' A' ' 62' ' ' GLU . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.49 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 52.01 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.88 HD21 HG21 ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 62.02 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 54.24 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.408 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 63.3 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 72.22 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.57 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 62.43 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 72.14 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.88 HG21 HD21 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 63.25 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.835 HG23 ' HE1' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 62.14 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.524 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.428 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 71.44 111.133 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 63.2 110.858 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 81' ' ' TYR . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 72.25 111.146 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.822 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.03 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 62.34 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.441 ' HA ' HD11 ' A' ' 129' ' ' ILE . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 53.21 110.858 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 51.1 110.862 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 71.12 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 64.34 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . 0.46 ' CA ' HD13 ' A' ' 11' ' ' LEU . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 25.35 112.539 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 71.15 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.12 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 63.01 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.686 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 65.03 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 70.44 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 43.43 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.067 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 61.34 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 71.24 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 64.51 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 71.25 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 54.51 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 63.11 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 63.5 110.918 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 64.42 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 64.12 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 62.03 110.925 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.31 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 73.32 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 142' ' ' GLU . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.799 ' O ' HD22 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 74.34 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.763 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 65.2 110.891 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.514 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 62.43 110.924 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 71.42 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -41.04 -78.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.099 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 147' ' ' GLY . 8.3 t -156.75 33.14 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 44.34 110.893 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 146' ' ' SER . . . -35.61 148.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.747 -0.74 . . . . 70.24 112.58 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 114.88 3.85 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.666 2.244 . . . . 64.42 112.293 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.2 t -90.89 157.42 17.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 60.31 110.895 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.3 t -88.74 66.66 8.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.853 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.699 -0.763 . . . . 73.32 112.481 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.522 -0.231 . . . . 55.53 112.522 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.47 -57.22 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.826 0.346 . . . . 61.12 110.818 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.4 t 68.2 115.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.077 -0.511 . . . . 73.52 110.863 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.68 -87.63 1.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 61.12 112.468 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.62 41.65 3.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.945 0.402 . . . . 73.11 110.866 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.64 104.52 7.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 71.52 110.799 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 63.48 126.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.706 -0.759 . . . . 54.54 112.465 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.4 p -99.69 82.73 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 73.52 110.869 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -172.23 88.62 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 74.15 110.865 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 84.5 p -125.97 153.92 43.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 62.44 110.849 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 mt -136.08 -178.04 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.3 110.939 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 12' ' ' VAL . 14.4 p -106.33 45.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 62.14 111.141 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.425 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.4 p -36.42 153.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.227 -0.442 . . . . 73.54 111.149 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.425 ' N ' HG22 ' A' ' 13' ' ' VAL . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.794 HG21 HG21 ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 73.43 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.696 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 60.04 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 52.11 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.041 HD13 ' HB2' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 70.44 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.766 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NE ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.71 157.88 24.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 72.33 110.92 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 32.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 63.15 110.945 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.472 ' HB2' ' NE ' ' A' ' 30' ' ' ARG . 60.7 mm-40 -104.1 179.06 4.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 65.25 110.906 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.7 p -155.94 22.63 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.22 111.182 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -123.09 -175.66 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 64.22 110.87 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.085 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.466 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 54.11 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 61.54 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.749 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 65.02 110.906 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.789 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.14 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 71.5 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.422 HG11 ' HG ' ' A' ' 117' ' ' LEU . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' OD2' ' A' ' 17' ' ' ASP . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.096 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.696 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 73.43 110.848 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.48 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.1 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.4 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.95 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.24 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.503 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 50.01 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 64.12 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.34 110.894 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 70.33 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.48 ' HG3' HD13 ' A' ' 55' ' ' LEU . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.753 HD21 HG21 ' A' ' 75' ' ' VAL . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 62.1 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.753 HG21 HD21 ' A' ' 67' ' ' LEU . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 50.32 111.111 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.749 HG23 ' HE1' ' A' ' 40' ' ' MET . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 64.12 111.109 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 64.12 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 73.23 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.32 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.505 HG22 ' N ' ' A' ' 83' ' ' HIS . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 54.13 111.065 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.505 ' N ' HG22 ' A' ' 82' ' ' VAL . 15.7 m80 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 63.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 73.01 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 71.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 82' ' ' VAL . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.2 111.106 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 51.2 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 71.44 112.381 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.766 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.41 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 64.35 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.545 ' CG ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 70.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.482 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 65.41 111.015 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 74.45 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 52.44 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 61.51 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 54.21 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.789 ' CE2' HG12 ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.33 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 51.12 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 62.15 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.482 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.495 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.898 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.545 HG22 ' CG ' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 45.43 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.794 HG21 HG21 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.041 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 64.23 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' PHE . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 32.42 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 65.22 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 61.13 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 62.25 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 70.43 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 63.45 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.693 HD13 ' N ' ' A' ' 141' ' ' LYS . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 62.31 110.984 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.693 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.33 110.924 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 62.01 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -40.87 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.52 69.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 72.0 110.794 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 56.15 172.95 0.15 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.733 -0.746 . . . . 72.2 112.494 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 106.23 1.63 Allowed 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.727 2.285 . . . . 72.33 112.315 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 158.77 17.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 65.04 110.893 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 68.0 m -39.18 132.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 74.41 110.892 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 74.14 112.469 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.5 -0.24 . . . . 64.53 112.5 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -124.55 161.57 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.937 0.398 . . . . 64.32 110.818 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m 61.01 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 71.45 110.9 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.93 -61.86 0.3 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.802 -0.713 . . . . 41.31 112.478 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.78 109.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.842 0.353 . . . . 70.31 110.866 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 t -135.72 -46.41 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 71.34 110.839 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.1 108.31 0.27 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 35.11 112.499 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 t -129.16 175.12 8.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 54.33 110.784 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.8 79.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.061 -0.518 . . . . 73.53 110.885 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.95 174.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 63.41 110.846 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 mt -143.8 -174.79 4.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.22 110.97 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.421 HG21 ' HG2' ' A' ' 109' ' ' MET . 2.6 t -92.04 42.16 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 74.41 111.113 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t -41.25 106.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 75.32 111.148 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 16' ' ' VAL . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.43 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.605 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.22 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.966 HD13 ' HB2' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 55.31 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.737 ' CD2' HD21 ' A' ' 92' ' ' LEU . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 64.03 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -94.2 -177.11 4.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.21 110.804 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 33' ' ' THR . 6.9 mptt -60.69 -13.48 14.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.467 . . . . 64.32 110.913 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 7.4 mt-10 33.57 -134.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.919 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.839 HG22 ' OH ' ' A' ' 90' ' ' TYR . 2.6 p 51.03 16.97 0.39 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 54.44 111.151 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.567 ' ND2' HH21 ' A' ' 30' ' ' ARG . 7.7 p30 -155.75 119.92 4.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 54.23 110.9 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.412 HD11 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 63.34 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.684 ' SD ' HD21 ' A' ' 117' ' ' LEU . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 53.4 110.878 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.864 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 64.54 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 63.33 110.964 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.408 ' CG ' HG13 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.439 HG11 HD13 ' A' ' 117' ' ' LEU . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 52.24 111.187 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 63.44 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 64.23 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 71.14 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 72.21 110.869 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 51' ' ' LEU . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.405 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.0 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 51.15 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.96 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 72.03 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.481 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 55.04 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.618 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 64.54 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 71.41 110.87 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.493 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.493 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 73.35 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 41.31 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.623 HG23 ' HE1' ' A' ' 40' ' ' MET . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 72.44 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.401 ' HB2' HD21 ' A' ' 140' ' ' LEU . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 88' ' ' VAL . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 24.2 m80 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 82' ' ' VAL . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.22 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.839 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.737 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.499 ' SG ' HD21 ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.588 ' HB2' HD13 ' A' ' 123' ' ' LEU . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 52.33 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 60.13 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 62.41 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.22 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.864 ' CE2' HG12 ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 50.01 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 61.34 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 64.3 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.59 HG11 HG21 ' A' ' 126' ' ' VAL . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 72.12 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.644 HG21 HG21 ' A' ' 16' ' ' VAL . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.966 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.476 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 94' ' ' PHE . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 52.21 110.964 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.59 HG21 HG11 ' A' ' 118' ' ' VAL . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 71.23 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 72.52 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 52.11 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 65.2 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.618 HD21 ' HB3' ' A' ' 63' ' ' LEU . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.461 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 71.32 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 64.32 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 63.51 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.575 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.55 -68.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.127 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.11 38.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 71.45 110.819 -179.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 90.21 146.39 15.39 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.793 -0.717 . . . . 52.11 112.436 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.87 -171.97 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.64 2.227 . . . . 74.32 112.29 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 37.9 t -87.18 128.41 35.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 70.34 110.89 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.06 91.89 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 72.23 110.867 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.676 -0.773 . . . . 64.1 112.43 -179.976 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.46 -0.256 . . . . 71.42 112.46 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m 58.27 110.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.905 0.383 . . . . 65.42 110.845 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 97.4 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 63.12 110.924 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.41 106.4 0.28 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.736 -0.745 . . . . 72.34 112.477 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.39 163.87 12.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.841 0.353 . . . . 74.33 110.855 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 t -97.5 89.57 4.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 52.3 110.873 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 55.84 95.38 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.777 -0.725 . . . . 70.12 112.466 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.8 p 177.16 166.49 0.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.837 0.351 . . . . 42.4 110.817 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.96 119.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.816 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.416 ' C ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 p -67.9 139.37 56.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 55.42 110.881 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.416 ' HG ' ' C ' ' A' ' 10' ' ' SER . 4.4 mt -146.73 -164.58 2.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 71.4 110.928 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.411 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -101.65 38.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.086 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' C ' ' O ' ' A' ' 12' ' ' VAL . 89.7 t -36.2 103.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 72.43 111.149 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.13 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 63.45 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 60.13 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 61.2 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.664 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 64.14 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.475 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.066 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -78.72 172.18 14.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.62 37.82 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.42 110.918 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 7.7 mm-40 -110.89 178.35 4.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.913 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 72.6 p -153.53 29.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.169 -0.468 . . . . 72.42 111.137 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.71 174.39 10.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 72.43 110.884 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 70.1 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.766 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.34 110.881 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.861 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 71.45 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 60.42 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 63.24 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.784 HD11 ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 42.1 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.4 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.784 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 52.52 110.912 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.406 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.24 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.406 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.3 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.961 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 62.03 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.492 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 73.32 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.492 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.898 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' HD13 ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.34 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.849 HD21 HG21 ' A' ' 75' ' ' VAL . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.437 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 62.21 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.437 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 63.35 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.403 ' CD2' HD22 ' A' ' 117' ' ' LEU . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.849 HG21 HD21 ' A' ' 67' ' ' LEU . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 60.01 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.766 HG23 ' HE1' ' A' ' 40' ' ' MET . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.507 ' HB2' HD12 ' A' ' 95' ' ' ILE . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.932 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 83' ' ' HIS . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.427 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.6 m80 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 71.0 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 74.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 123' ' ' LEU . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 72.52 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 77' ' ' TYR . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 73.22 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.446 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 52.14 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 62.34 110.898 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.03 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 71.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 52.42 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 72.34 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.861 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.534 ' O ' HG23 ' A' ' 118' ' ' VAL . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 62.14 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 65.4 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HG22 ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 114' ' ' LYS . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 70.3 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 64.13 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 72.55 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.066 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 50.31 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 94' ' ' PHE . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.918 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 55.04 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 71.15 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.14 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 54.24 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 52.42 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 73.24 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 65.2 110.954 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 71.33 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.474 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 142' ' ' GLU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.14 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.769 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.769 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.01 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 64.34 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.64 -62.78 1.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 70.42 111.133 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.96 39.78 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.33 110.903 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -52.42 154.27 5.66 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.728 -0.749 . . . . 52.12 112.461 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 101.94 0.96 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.663 2.242 . . . . 62.11 112.4 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.9 175.29 7.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 63.44 110.826 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.72 103.1 10.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 62.41 110.819 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.773 -0.727 . . . . 70.42 112.415 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.402 ' O ' ' HB1' ' A' ' 111' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.47 -0.252 . . . . 44.04 112.47 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 p -127.86 163.12 25.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.354 . . . . 75.25 110.856 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.4 m -80.82 -54.0 5.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.485 . . . . 53.22 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.17 98.46 1.27 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.11 112.495 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.49 -67.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.886 0.374 . . . . 61.24 110.801 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -176.11 157.98 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 65.24 110.866 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.42 -135.93 2.67 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.768 -0.73 . . . . 55.14 112.502 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 t -151.59 154.05 35.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 60.45 110.908 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.41 45.44 0.96 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 72.45 110.954 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 m -162.41 131.76 4.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 65.43 110.867 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -135.85 -175.01 3.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.3 110.906 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 12' ' ' VAL . 9.0 p -95.87 44.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.167 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p -39.52 149.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.09 -0.505 . . . . 74.3 111.136 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 1.026 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 54.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.949 HG21 HG21 ' A' ' 120' ' ' THR . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 73.22 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 72.22 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 65.4 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.08 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 55.1 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.719 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 62.25 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 73.44 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.429 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -71.55 166.29 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -96.35 34.51 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 63.34 110.972 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.08 179.0 4.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 64.02 110.873 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.0 p -149.02 20.3 0.98 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.182 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -122.78 -179.8 4.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 61.44 110.879 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 72.3 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 62.2 111.137 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.547 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 64.51 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.722 ' HG2' HD11 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 61.22 110.871 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 71.45 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.614 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 65.04 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 51.15 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 73.33 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.462 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 1.026 HG23 ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.462 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.633 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 61.34 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.547 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 HD13 ' HG3' ' A' ' 66' ' ' GLU . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 43.4 110.898 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.948 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 65.21 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 43.24 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 62.35 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.639 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 61.1 110.908 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 61.14 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG3' HD13 ' A' ' 55' ' ' LEU . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.867 HD21 HG21 ' A' ' 75' ' ' VAL . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 71.43 110.958 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 62.22 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 55.24 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.581 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.572 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.867 HG21 HD21 ' A' ' 67' ' ' LEU . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 53.13 111.171 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.695 HG23 ' HE1' ' A' ' 40' ' ' MET . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 70.24 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.591 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.574 ' N ' HG12 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 71.21 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.13 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 72.52 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.719 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 64.42 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.852 ' HB2' HD13 ' A' ' 123' ' ' LEU . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 64.01 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.24 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 52.54 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 55.21 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 55.2 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.614 ' CE2' HG12 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.402 ' HB1' ' O ' ' A' ' 1' ' ' GLY . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.117 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 34.22 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 61.31 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 64.11 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 HG11 ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.531 HG22 ' CG ' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 64.41 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.949 HG21 HG21 ' A' ' 16' ' ' VAL . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 55.42 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.08 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.437 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.852 HD13 ' HB2' ' A' ' 94' ' ' PHE . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.734 HG13 ' HD2' ' A' ' 94' ' ' PHE . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.567 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.582 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 63.03 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 63.51 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 74.21 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 61.13 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.582 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.639 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 65.21 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 71.35 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 73.2 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.591 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.567 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 140' ' ' LEU . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 72.31 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.57 -56.77 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.6 p -79.47 47.52 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.919 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.97 147.04 49.03 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.684 -0.769 . . . . 63.04 112.537 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 179.94 3.33 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.728 2.286 . . . . 62.45 112.327 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.3 t -50.87 154.16 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 71.01 110.883 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.2 t 71.57 93.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 73.02 110.813 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.761 -0.733 . . . . 53.42 112.445 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.529 -0.228 . . . . 64.43 112.529 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.3 m -55.45 166.9 0.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.845 0.355 . . . . 70.34 110.852 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.4 p -165.79 145.17 6.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.31 110.922 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 5' ' ' SER . . . -68.03 149.42 50.21 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 75.52 112.5 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 4' ' ' GLY . 24.5 m -35.61 -47.68 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 74.44 110.884 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.443 ' O ' ' C ' ' A' ' 7' ' ' GLY . 1.4 t -173.04 -55.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 75.33 110.766 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' A' ' 6' ' ' SER . . . 34.56 -130.13 0.55 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 62.24 112.534 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -152.62 29.92 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 50.0 110.83 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 59.08 46.28 13.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 62.13 110.858 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.7 m -132.74 137.72 46.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 72.23 110.859 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.474 HD13 ' CA ' ' A' ' 112' ' ' GLY . 8.7 mt -136.35 -169.29 2.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 61.04 110.952 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.434 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.3 t -95.38 41.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 71.24 111.143 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 12' ' ' VAL . 97.1 t -34.69 108.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 73.31 111.177 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 41.43 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.915 HG21 HG21 ' A' ' 120' ' ' THR . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 45.02 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 64.41 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.703 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.24 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.107 HD13 ' HB2' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 50.33 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 64.51 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.21 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 72.25 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.4 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.479 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -73.08 172.65 10.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.91 37.12 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 55.02 110.892 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 27.3 mt-10 -116.59 169.77 9.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 64.11 110.89 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.4 p -142.72 22.29 1.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 75.32 111.124 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -121.27 -174.23 2.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 65.53 110.877 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 70.34 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 64.31 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.476 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 74.41 111.131 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 60.3 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.758 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.756 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 70.34 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 35.05 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 73.12 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.14 110.905 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.975 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 71.43 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.501 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.501 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.53 ' O ' HD13 ' A' ' 65' ' ' LEU . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 42.31 110.897 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 63.42 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.674 HD21 HG21 ' A' ' 75' ' ' VAL . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 51.23 110.91 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.481 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 55.25 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.554 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 42.21 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 70.13 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.674 HG21 HD21 ' A' ' 67' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.32 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.758 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.496 HG12 ' N ' ' A' ' 83' ' ' HIS . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 61.21 111.154 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.496 ' N ' HG12 ' A' ' 82' ' ' VAL . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 70.04 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 44.11 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.24 112.345 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.938 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.658 ' HB2' HD13 ' A' ' 123' ' ' LEU . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 70.44 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 71.12 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 52.31 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 72.41 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 50.35 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.756 ' CE2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 71.45 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . 0.474 ' CA ' HD13 ' A' ' 11' ' ' LEU . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 71.32 112.494 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 54.14 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 52.22 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.633 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.549 HG22 ' CG ' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.915 HG21 HG21 ' A' ' 16' ' ' VAL . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 61.24 111.155 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.107 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 51.21 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.438 HG23 ' HG3' ' A' ' 125' ' ' LYS . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.438 ' HG3' HG23 ' A' ' 124' ' ' THR . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' A' ' 94' ' ' PHE . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 62.4 111.104 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 72.42 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 71.23 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 63.02 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 72.24 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 62.25 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.55 HG22 ' HG3' ' A' ' 142' ' ' GLU . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 62.43 111.136 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 61.24 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.796 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 60.13 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.55 ' HG3' HG22 ' A' ' 138' ' ' THR . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 61.54 110.821 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.585 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.19 -60.8 1.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.3 t -178.55 43.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 61.01 110.896 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -68.43 -170.99 6.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.757 -0.735 . . . . 74.15 112.46 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -176.88 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.721 2.281 . . . . 74.24 112.257 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 27.6 t -171.17 85.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 64.43 110.904 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.7 m -135.8 88.28 2.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 61.44 110.822 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 53.24 112.479 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.55 -0.22 . . . . 72.51 112.55 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.78 170.81 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.839 0.352 . . . . 51.31 110.909 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 m 51.45 98.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 62.33 110.799 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.08 -67.97 0.52 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.779 -0.724 . . . . 41.43 112.534 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.2 m -64.5 148.67 50.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.888 0.375 . . . . 73.32 110.871 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.9 m -133.52 161.54 34.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.24 110.914 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.0 -42.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.79 -0.719 . . . . 41.2 112.525 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m 42.16 43.72 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.836 0.35 . . . . 72.11 110.856 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -125.84 -141.03 0.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 52.12 110.898 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.1 m -140.66 143.63 35.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 74.41 110.869 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.405 HD23 ' SD ' ' A' ' 108' ' ' MET . 9.9 mt -133.08 179.22 6.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.463 . . . . 63.15 110.912 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.449 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.7 t -92.95 38.07 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 63.53 111.175 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.449 ' C ' ' O ' ' A' ' 12' ' ' VAL . 2.3 p -34.0 145.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 70.45 111.178 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 45.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 71.15 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.03 HG21 HG21 ' A' ' 120' ' ' THR . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 73.44 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 51' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.13 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.54 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 72.11 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 72.53 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.776 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.55 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 65.12 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.11 163.07 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.42 27.18 1.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.854 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 11.0 mt-10 -103.92 171.44 7.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 61.32 110.867 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.8 p -150.35 32.63 0.65 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 75.54 111.169 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -131.4 -179.39 5.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 62.34 110.857 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.473 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.746 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 64.33 110.864 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.831 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 72.2 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.406 ' CG ' ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HG3' ' CG ' ' A' ' 45' ' ' ASP . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 72.11 110.885 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 62.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.448 HG11 HD23 ' A' ' 117' ' ' LEU . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 52.01 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.735 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.425 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 53.21 110.91 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.05 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.963 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 73.45 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 61.23 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 61.53 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.644 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 64.2 110.934 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 72.13 110.894 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.758 HD21 HG21 ' A' ' 75' ' ' VAL . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.419 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 54.51 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.456 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.758 HG21 HD21 ' A' ' 67' ' ' LEU . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 64.14 111.106 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.746 HG23 ' CE ' ' A' ' 40' ' ' MET . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.49 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 72.43 110.936 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.546 ' HB2' HD21 ' A' ' 140' ' ' LEU . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.23 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 64.42 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.523 ' N ' HG12 ' A' ' 82' ' ' VAL . 35.4 m80 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 73.23 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 53.11 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.41 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.776 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 52.42 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 60.44 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.612 ' CG ' HG22 ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.49 HD12 ' HB2' ' A' ' 77' ' ' TYR . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 65.44 111.116 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.574 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 52.22 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.12 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.419 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 73.2 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.3 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.405 ' SD ' HD23 ' A' ' 11' ' ' LEU . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.831 ' CE2' HG12 ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.574 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.472 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 53.4 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 71.54 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . 1.03 HG21 HG21 ' A' ' 16' ' ' VAL . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 54.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 62.52 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 94' ' ' PHE . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 63.32 110.965 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 52.15 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 71.01 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.61 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 63.24 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 52.04 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.644 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 61.32 110.85 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 45.2 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 63.05 110.853 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 64.11 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.628 HD13 ' HG2' ' A' ' 91' ' ' PRO . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.39 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 30.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 74.4 110.912 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.75 149.47 13.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.739 -0.743 . . . . 63.05 112.407 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 6.62 1.25 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.272 . . . . 73.33 112.32 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.2 t -116.17 -61.47 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 72.0 110.799 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 9.0 t -83.4 44.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 42.43 110.88 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.76 -0.734 . . . . 74.42 112.439 -179.928 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.512 -0.235 . . . . 71.4 112.512 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 m 38.79 80.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 73.35 110.903 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.22 -45.07 88.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 71.13 110.838 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.48 105.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.729 -0.748 . . . . 32.12 112.426 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.67 -62.66 1.65 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.877 0.37 . . . . 60.1 110.829 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.75 177.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.895 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -40.64 103.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 45.24 112.476 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.6 m -100.65 83.48 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 63.42 110.853 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -175.53 83.78 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 75.14 110.909 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.1 159.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 70.15 110.834 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -141.05 -176.11 4.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 70.51 110.889 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 12' ' ' VAL . 9.2 t -90.59 37.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 74.41 111.184 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.419 ' C ' ' O ' ' A' ' 12' ' ' VAL . 93.5 t -36.14 95.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 52.31 111.174 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.444 ' N ' ' O ' ' A' ' 12' ' ' VAL . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.06 HG21 HG21 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.45 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 64.52 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.493 ' O ' HD23 ' A' ' 20' ' ' LEU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 51.55 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 63.12 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.98 HD13 ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 61.11 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 72.44 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -73.67 161.67 30.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 43.04 110.926 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -86.77 31.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 64.41 110.973 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 68.4 mm-40 -112.52 174.56 5.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 70.03 110.91 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 75.2 p -147.99 32.88 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 64.14 111.122 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.81 178.49 7.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 75.41 110.901 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 62.15 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.506 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 61.23 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.45 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG23 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 62.35 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.02 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.88 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 63.25 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 63.4 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 117' ' ' LEU . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.425 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 52.33 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 65.12 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 54.33 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.698 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 64.14 110.838 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.444 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 3.2 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.981 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.49 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.685 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 74.32 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.12 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.657 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 73.5 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.523 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 73.32 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.431 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 64.33 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.431 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 62.53 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 1.043 HG21 HD21 ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 45.4 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 76' ' ' VAL . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 61.31 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 73.53 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 72.21 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 72.31 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 51.45 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 81' ' ' TYR . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.508 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.05 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 61.33 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.72 ' CE1' HD12 ' A' ' 117' ' ' LEU . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 62.44 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.441 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 61.04 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 62.25 110.875 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.416 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 53.35 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 60.34 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 71.21 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 74.53 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 71.53 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.88 ' CE2' HG12 ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 55.03 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.72 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.688 HG22 ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 73.33 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 61.52 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . 1.06 HG21 HG21 ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 63.11 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.98 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.575 HD13 ' HB2' ' A' ' 94' ' ' PHE . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.858 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.638 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.109 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 71.35 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.592 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 71.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.596 HG23 ' OD1' ' A' ' 134' ' ' ASP . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 60.45 111.126 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.04 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 53.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.596 ' OD1' HG23 ' A' ' 131' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.685 HD22 ' O ' ' A' ' 60' ' ' PRO . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 71.3 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.592 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.767 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.767 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 62.02 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.454 HD13 ' HG2' ' A' ' 91' ' ' PRO . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -53.87 -60.71 2.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 55.43 111.12 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.84 44.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 64.04 110.821 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -45.37 151.77 0.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.718 -0.753 . . . . 53.02 112.528 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -174.11 0.85 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.678 2.252 . . . . 72.02 112.369 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 13.4 m -120.37 -62.56 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.293 -0.412 . . . . 64.34 110.859 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.59 103.0 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.23 110.871 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.716 -0.754 . . . . 44.53 112.516 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.464 -0.254 . . . . 73.3 112.464 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 113.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.858 0.361 . . . . 71.1 110.888 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.9 t -170.84 42.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 34.32 110.81 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.81 -165.26 32.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.698 -0.763 . . . . 43.2 112.491 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 t -157.97 139.35 13.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.919 0.39 . . . . 75.54 110.853 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.0 p -133.78 165.79 24.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.099 -0.501 . . . . 74.11 110.861 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -45.42 -82.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.701 -0.761 . . . . 53.14 112.573 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -66.92 149.93 49.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 73.11 110.866 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.46 83.36 2.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.82 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 94.0 p -118.14 148.05 42.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.42 110.872 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.6 mt -136.94 176.99 8.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.35 110.96 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 12' ' ' VAL . 13.7 p -92.96 43.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 75.33 111.071 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -37.64 152.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.245 -0.434 . . . . 51.2 111.125 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 53.3 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 72.32 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 70.3 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 63.51 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 70.4 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.772 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 72.23 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.78 169.74 17.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.83 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 36.68 1.6 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 60.35 110.886 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.469 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 6.3 mm-40 -106.8 -177.9 3.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 74.5 110.832 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 p -156.16 21.6 0.37 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 61.22 111.223 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -126.72 177.27 6.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 74.1 110.875 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 61.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 60.34 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.589 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 62.32 111.101 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.776 ' CE ' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.76 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 65.52 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 71.52 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.418 HG11 HD13 ' A' ' 117' ' ' LEU . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 54.04 111.14 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.401 HG12 ' OD2' ' A' ' 17' ' ' ASP . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.472 HD13 ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 70.35 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.434 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 63.4 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.434 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.951 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.633 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 70.01 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 65.42 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.413 ' CD2' HG21 ' A' ' 75' ' ' VAL . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.479 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 52.22 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' PRO . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 64.12 110.991 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.424 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.479 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CD2' HD22 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 67' ' ' LEU . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.211 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.776 HG23 ' CE ' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.587 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.02 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.452 HG13 ' HB ' ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 62.21 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 24.9 m80 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 74.42 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 55.42 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.452 ' HB ' HG13 ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.496 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.772 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 70.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.5 ' SG ' HD21 ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 71.23 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.32 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 71.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 61.55 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 70.22 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.58 ' HG2' HG11 ' A' ' 12' ' ' VAL . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.76 ' CE2' HG12 ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 61.41 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 54.53 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.3 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.559 HD22 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 74.55 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.439 HG22 ' CD1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.718 HG21 HG21 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 71.31 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 52.55 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 64.4 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.23 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.633 HD21 ' HB3' ' A' ' 63' ' ' LEU . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.22 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 62.14 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 79' ' ' TYR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 71.42 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 72.52 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 64.33 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -37.92 -67.81 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 61.13 111.089 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.53 42.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 71.12 110.82 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -58.66 170.62 4.82 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 61.42 112.515 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 -176.58 1.54 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.655 2.237 . . . . 74.22 112.289 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.11 -52.14 1.65 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 51.32 110.869 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.6 150.78 25.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 75.12 110.884 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.852 -0.69 . . . . 44.33 112.429 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 112.489 -0.244 . . . . 73.4 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 53.9 170.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.941 0.401 . . . . 73.32 110.832 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.9 t -164.81 170.52 15.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.809 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.09 -96.1 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 74.31 112.47 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -155.62 85.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.927 0.394 . . . . 64.53 110.879 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 178.09 169.73 0.74 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.048 -0.524 . . . . 53.02 110.897 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.33 -92.39 1.23 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.749 -0.739 . . . . 52.45 112.554 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -162.51 -45.6 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 65.25 110.864 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 39.94 84.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 73.22 110.896 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.5 m -91.66 123.13 34.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.52 110.832 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.6 mt -133.83 -167.29 1.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.899 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.8 t -98.12 50.19 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 72.34 111.178 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t -42.08 112.76 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 41.42 111.159 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.803 HG21 HG21 ' A' ' 120' ' ' THR . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 63.23 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.13 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 44.53 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 62.44 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 71.41 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.085 HD13 ' HB2' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 63.34 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 71.41 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 53.51 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.8 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -76.05 155.79 34.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 30.58 0.62 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 72.35 110.884 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 28.4 mt-10 -108.88 172.55 6.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 65.31 110.911 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.7 p -146.46 33.72 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 64.14 111.11 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.27 173.55 11.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.1 110.9 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.831 HG23 ' CG ' ' A' ' 54' ' ' GLU . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.42 HG12 HG22 ' A' ' 75' ' ' VAL . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.678 ' HE1' HG23 ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.2 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 73.33 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.847 HG11 HD13 ' A' ' 117' ' ' LEU . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 65.31 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 62.34 110.919 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.413 ' CG ' ' O ' ' A' ' 52' ' ' GLU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.831 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.559 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 65.55 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.495 ' O ' HG22 ' A' ' 58' ' ' ILE . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.984 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 71.54 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.685 ' O ' HD13 ' A' ' 65' ' ' LEU . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.53 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HG2' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 61' ' ' GLU . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.559 ' HG3' HD13 ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 1.008 HD21 HG21 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.501 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 61.54 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.583 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 53.44 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.902 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.491 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.2 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 1.008 HG21 HD21 ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 51.52 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.678 HG23 ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.451 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.722 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 62.11 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.566 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 64.04 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.433 HG21 ' HE2' ' A' ' 80' ' ' LYS . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 63.01 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.561 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 44.33 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.413 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.8 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 71.14 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.506 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 55.11 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.581 ' HD2' HG23 ' A' ' 126' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 70.42 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.484 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 64.11 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.599 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 72.05 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.23 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.33 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 63.01 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 61.13 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 44.34 112.458 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.591 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.12 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.52 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 49' ' ' VAL . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 114' ' ' LYS . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 73.41 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.803 HG21 HG21 ' A' ' 16' ' ' VAL . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 64.13 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.085 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 52.42 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.581 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 73.23 111.121 179.906 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 63.22 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.534 HG22 ' HB3' ' A' ' 134' ' ' ASP . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.54 111.134 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 65.54 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.52 HG23 HH22 ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.534 ' HB3' HG22 ' A' ' 129' ' ' ILE . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 50.02 110.884 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.419 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' A' ' 79' ' ' TYR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 71.13 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.538 HD11 HD11 ' A' ' 140' ' ' LEU . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.05 -69.01 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -173.75 39.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 71.2 110.861 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 78.35 145.72 2.81 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.76 -0.733 . . . . 72.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 115.2 3.98 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.676 2.251 . . . . 64.52 112.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 5.8 t -124.84 136.47 53.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 73.3 110.844 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 78.4 p -100.09 131.71 45.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.846 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 15.24 112.501 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.423 -0.271 . . . . 62.3 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -112.45 128.55 56.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.88 0.371 . . . . 45.11 110.886 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.2 p 41.23 89.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 74.21 110.844 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.91 153.28 9.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.726 -0.749 . . . . 63.42 112.555 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 m 58.58 166.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 53.01 110.865 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.51 109.68 10.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.828 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -167.69 -178.87 40.05 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 61.33 112.475 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -76.02 123.38 25.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.937 0.399 . . . . 64.43 110.786 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 23.3 p-10 -160.26 85.14 0.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 75.53 110.939 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.6 m -90.64 129.81 36.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 54.25 110.866 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.5 mt -130.71 176.2 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 74.55 110.926 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.702 HG22 ' O ' ' A' ' 12' ' ' VAL . 7.9 p -92.7 43.24 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 73.11 111.187 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.407 ' C ' ' O ' ' A' ' 12' ' ' VAL . 57.8 t -35.81 145.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.41 111.127 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 HG21 ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 32.42 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.492 ' OD2' HG12 ' A' ' 50' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.51 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 61.13 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.01 HD13 ' HB2' ' A' ' 121' ' ' ALA . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 64.53 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 71.42 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -88.07 -174.82 4.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 33' ' ' THR . 1.9 mttm -62.32 -8.65 6.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.902 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' A' ' 31' ' ' LYS . 1.6 mp0 31.21 -135.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 74.34 110.884 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.915 HG22 ' OH ' ' A' ' 90' ' ' TYR . 2.2 p 51.71 16.47 0.48 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 30.43 111.14 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.45 ' ND2' HH21 ' A' ' 30' ' ' ARG . 6.9 p30 -155.03 120.07 4.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 53.23 110.89 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 54.45 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 35.05 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.616 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 HG22 ' A' ' 75' ' ' VAL . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 64.42 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.838 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 52.14 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 52.3 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.4 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.25 110.894 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.879 HG11 HD13 ' A' ' 117' ' ' LEU . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' OD2' ' A' ' 17' ' ' ASP . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 71.32 111.144 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 64.42 110.896 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.412 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 72.42 110.975 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.0 m120 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 63.33 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.928 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.644 ' O ' HD13 ' A' ' 65' ' ' LEU . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 55' ' ' LEU . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.781 HD21 HG21 ' A' ' 75' ' ' VAL . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 70.33 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.452 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 53.42 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.579 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.452 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.658 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.781 HG21 HD21 ' A' ' 67' ' ' LEU . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.405 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.906 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 61.43 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 65.34 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.455 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 72.52 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 72.23 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.404 ' HB ' HG13 ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.15 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.915 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.602 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.473 ' HB2' HD13 ' A' ' 123' ' ' LEU . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 62.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.439 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 52.13 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 71.34 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 65.13 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 70.22 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.838 ' CE2' HG12 ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 71.4 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 72.03 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 73.45 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.879 HD13 HG11 ' A' ' 49' ' ' VAL . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.24 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.903 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 54.02 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.01 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 65.2 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 62.42 110.936 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 72.21 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 65.42 110.952 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.558 HG22 ' HG3' ' A' ' 142' ' ' GLU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.23 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.642 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.642 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 71.21 110.891 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.558 ' HG3' HG22 ' A' ' 138' ' ' THR . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 63.42 110.886 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.89 -75.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 62.42 111.043 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.36 34.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 65.43 110.815 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 67.91 179.82 16.66 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 60.3 112.457 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -175.14 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.666 2.244 . . . . 60.04 112.313 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.33 154.44 16.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 71.21 110.852 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.39 165.65 32.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 65.31 110.946 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 71.22 112.447 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.48 -0.248 . . . . 63.41 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -161.43 -57.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.877 0.37 . . . . 54.31 110.838 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.27 140.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.3 110.843 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.16 -144.24 18.36 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.751 -0.737 . . . . 61.42 112.567 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.2 p -155.96 129.92 8.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 74.52 110.841 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.0 p -120.13 164.58 15.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 74.25 110.868 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.09 133.08 6.22 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 54.31 112.489 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.5 t -40.76 152.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 60.31 110.891 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -102.6 42.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 63.13 110.889 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.5 m -137.83 117.83 13.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.14 110.901 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.6 mt -129.44 -179.43 5.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 74.02 110.944 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 12' ' ' VAL . 8.0 p -95.74 39.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 74.55 111.196 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.446 ' C ' ' O ' ' A' ' 12' ' ' VAL . 76.2 t -34.08 122.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 61.11 111.096 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.99 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.816 HG11 HG21 ' A' ' 120' ' ' THR . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 70.0 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 40' ' ' MET . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.35 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 71.03 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.007 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 62.41 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.738 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.458 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 64.44 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 64.13 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -69.17 176.89 2.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 64.1 110.968 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.38 39.25 1.86 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 75.32 110.901 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 11.6 mt-10 -119.45 174.33 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.25 110.881 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.6 p -147.75 32.42 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 70.52 111.14 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -135.42 -174.88 3.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.247 -0.433 . . . . 73.22 110.865 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 60.22 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 53.15 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 53.3 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.433 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 71.53 111.155 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.79 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.945 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 62.13 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.725 ' NH2' HG21 ' A' ' 50' ' ' VAL . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 61.13 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 48' ' ' MET . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 72.52 110.905 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.99 HG23 ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.725 HG21 ' NH2' ' A' ' 46' ' ' ARG . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.734 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.437 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 73.2 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.406 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.406 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.986 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.563 ' O ' HD13 ' A' ' 65' ' ' LEU . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 60.14 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.692 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 72.22 110.974 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 61' ' ' GLU . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.11 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.66 HD21 HG21 ' A' ' 75' ' ' VAL . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 63.24 110.874 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.485 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 51.45 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 72.43 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.485 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.66 HG21 HD21 ' A' ' 67' ' ' LEU . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 65.34 111.175 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.79 HG23 ' CE ' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.565 ' HB2' HD12 ' A' ' 95' ' ' ILE . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.547 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 50.11 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.667 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.513 HG13 ' HB ' ' A' ' 88' ' ' VAL . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 53.5 111.207 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.422 ' N ' HG12 ' A' ' 82' ' ' VAL . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 60.14 110.899 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 52.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 44.12 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 81' ' ' TYR . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 54.44 111.158 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 62.1 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.547 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 72.24 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.738 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 54.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.565 ' CZ ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 64.44 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.565 HD12 ' HB2' ' A' ' 77' ' ' TYR . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.23 111.133 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.496 ' HA ' HD11 ' A' ' 129' ' ' ILE . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.14 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 73.35 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 73.35 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 62.44 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.33 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.469 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.945 ' CE2' HG12 ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 62.23 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.751 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.565 HG22 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.816 HG21 HG11 ' A' ' 16' ' ' VAL . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.007 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.51 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.538 HG23 ' HG2' ' A' ' 125' ' ' LYS . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 62.24 111.116 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' A' ' 124' ' ' THR . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 HG11 ' A' ' 118' ' ' VAL . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 73.23 111.147 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.02 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.594 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 52.15 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 71.43 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.692 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.528 HG22 ' HG3' ' A' ' 142' ' ' GLU . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 61.1 111.148 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.72 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.72 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.528 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 62.42 110.924 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 71.43 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.95 -60.38 3.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 23.53 111.14 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.7 p -86.32 31.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 63.52 110.916 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 42.65 -162.21 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.727 -0.749 . . . . 44.12 112.558 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -173.81 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.694 2.263 . . . . 65.41 112.365 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 51.0 m 44.79 91.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 75.34 110.869 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 53.2 p -160.09 127.02 4.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 52.11 110.851 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 73.13 112.517 -179.971 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.518 -0.233 . . . . 73.2 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -153.84 -48.89 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 61.44 110.799 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 93.6 p -121.42 154.01 37.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.45 110.832 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 -81.2 0.2 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.783 -0.723 . . . . 65.11 112.47 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.02 167.79 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 70.01 110.825 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -66.36 176.47 1.81 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 62.14 110.883 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.72 -166.54 24.53 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 65.32 112.419 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -136.37 138.27 41.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.891 0.377 . . . . 72.31 110.812 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -171.25 46.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.42 110.826 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.84 163.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 60.41 110.812 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 mt -136.13 177.41 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 73.04 110.909 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.82 HG11 ' HG2' ' A' ' 109' ' ' MET . 10.0 p -93.9 43.69 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 75.52 111.082 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t -40.26 119.73 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 74.45 111.063 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.05 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 70.03 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.726 HG21 HG21 ' A' ' 120' ' ' THR . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 53.31 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.487 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 72.31 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 62.2 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 -65.7 172.3 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -98.02 31.04 2.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 60.13 110.923 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -123.38 171.26 9.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 42.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 p -140.3 37.05 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 64.14 111.199 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -132.25 174.77 9.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 65.31 110.859 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 55.35 111.072 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.484 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 60.5 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 ' CG ' ' A' ' 54' ' ' GLU . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.569 HG23 ' HG3' ' A' ' 73' ' ' ARG . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 64.11 111.145 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.535 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 51.21 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.883 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 70.33 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 43.21 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.667 HG11 HD13 ' A' ' 117' ' ' LEU . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.487 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 62.24 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 20' ' ' LEU . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.635 ' N ' HD23 ' A' ' 51' ' ' LEU . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.465 ' N ' HD23 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.519 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 52.03 110.952 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.991 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 71.05 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.512 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.512 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' HD23 ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 61.21 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 72.32 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.736 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.558 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 55' ' ' LEU . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.888 HD22 ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 63.11 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.486 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.423 ' HB2' ' NH1' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' NH1' ' HB2' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' PRO . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 55.05 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.888 ' NH1' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 73.0 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.623 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 61.43 111.117 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.535 HG23 ' HE1' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 63.34 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.641 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 70.12 111.13 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 27.0 m80 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 34.41 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.13 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.641 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 64.41 111.143 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 63.45 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 45.54 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.514 ' CG ' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 61.11 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.558 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.449 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 62.15 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 63.23 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 71.43 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 64.24 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 53.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 73.41 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.82 ' HG2' HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 70.12 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.883 ' CE2' HG12 ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 65.13 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 63.24 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.558 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.667 HD13 HG11 ' A' ' 49' ' ' VAL . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.514 HG22 ' CG ' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 44.31 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.726 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 65.14 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 62.41 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 54.41 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 64.45 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 70.25 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.489 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 64.44 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.736 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 71.3 110.939 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 64.24 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 61.01 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 70.11 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.34 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.573 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -54.78 -178.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 54.14 111.107 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -161.88 87.01 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.04 110.827 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -125.62 -158.91 10.12 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 43.12 112.528 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.79 -174.56 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.734 2.289 . . . . 75.24 112.351 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.25 114.73 22.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 71.1 110.907 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.73 120.58 37.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.33 110.798 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 C-N-CA 120.737 -0.744 . . . . 25.45 112.478 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.516 -0.234 . . . . 70.32 112.516 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 114.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.849 0.357 . . . . 63.42 110.819 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -46.83 134.44 10.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 71.4 110.823 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.54 -49.37 4.17 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.716 -0.754 . . . . 53.24 112.512 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.1 t -64.26 133.34 52.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.928 0.394 . . . . 71.03 110.882 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.03 -48.8 0.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 51.31 110.824 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.08 72.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.758 -0.734 . . . . 73.15 112.447 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.1 m -45.24 -59.64 2.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 74.13 110.87 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.21 84.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 73.31 110.863 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.3 p 49.5 179.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 73.23 110.928 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -140.51 -172.08 3.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 72.43 110.911 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -92.88 44.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.151 -0.477 . . . . 74.34 111.122 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t -39.09 114.29 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 72.51 111.098 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.0 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 52.31 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 62.4 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.784 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 51' ' ' LEU . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.942 HD13 ' HB2' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.744 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 65.11 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -68.28 165.34 18.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 71.15 110.882 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.09 20.16 6.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 73.52 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -101.75 168.96 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 72.42 110.856 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.5 p -141.02 36.38 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 50.23 111.141 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -138.5 172.9 12.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 74.51 110.876 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 64.05 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.4 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.516 HG23 ' HG3' ' A' ' 73' ' ' ARG . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 71.4 111.142 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.786 ' CE ' HG23 ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 64.5 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.778 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 72.31 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 73.33 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 71.3 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 51.34 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 52.33 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HB3' HG22 ' A' ' 39' ' ' ILE . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 51.45 110.864 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 62.54 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' HG22 ' A' ' 58' ' ' ILE . 3.4 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.03 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.93 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.02 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.502 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.502 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.633 ' O ' HD23 ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.929 179.843 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.633 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 54.21 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.765 HD13 HH12 ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.13 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.416 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.765 HH12 HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.5 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 117' ' ' LEU . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 43.23 111.154 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.786 HG23 ' CE ' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 60.24 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 60.45 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 72.04 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 83' ' ' HIS . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 72.34 111.168 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.475 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 41.21 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 65.12 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.744 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.627 ' CD1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 65.12 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.56 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.429 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 41.22 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.416 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 62.24 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 65.04 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.778 ' CE2' HG12 ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 65.25 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.603 HD21 ' SD ' ' A' ' 40' ' ' MET . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.627 HG22 ' CD1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 65.52 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.4 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.942 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 71.51 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.479 HD13 ' CD1' ' A' ' 94' ' ' PHE . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 54.51 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.494 HG22 HG11 ' A' ' 118' ' ' VAL . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.4 111.105 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 63.53 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.14 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.415 ' O ' HG23 ' A' ' 136' ' ' THR . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.56 HD12 ' C ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 65.44 110.929 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 50.21 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.464 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 62.51 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 70.54 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 55.32 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.84 -173.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 44.32 111.155 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 17.7 t -162.65 88.47 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 74.54 110.818 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -116.67 -165.62 14.05 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.642 -0.789 . . . . 72.23 112.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 5.49 1.7 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.637 2.225 . . . . 62.34 112.313 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 53.4 p -61.01 158.95 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 71.54 110.898 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.02 155.32 34.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 71.15 110.753 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.668 -0.777 . . . . 34.42 112.444 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.482 -0.247 . . . . 55.42 112.482 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -140.58 144.35 35.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 75.13 110.876 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.49 -54.69 2.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 75.2 110.853 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.39 40.43 0.8 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.67 -0.776 . . . . 73.03 112.526 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.6 m 60.39 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.827 0.346 . . . . 71.1 110.873 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.9 m -161.85 -45.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.472 . . . . 74.1 110.871 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -119.07 176.33 16.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.811 -0.709 . . . . 65.14 112.496 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.84 -59.92 1.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 64.24 110.883 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.94 42.17 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 72.33 110.891 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -157.57 157.13 33.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.31 110.891 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.1 mt -128.36 -179.79 5.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.919 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 12' ' ' VAL . 7.1 p -100.22 41.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 74.51 111.033 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t -39.23 127.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 61.0 111.133 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.873 HG21 HG21 ' A' ' 120' ' ' THR . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 61.51 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.517 ' CG ' HG12 ' A' ' 50' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.23 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 40.25 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.663 HD21 HD21 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 51' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 55.12 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.977 HD13 ' HB2' ' A' ' 121' ' ' ALA . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.636 ' CD1' HD11 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 61.1 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -76.02 173.75 10.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 65.14 110.867 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mmmt -103.01 39.4 1.56 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.894 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 38.8 mm-40 -110.09 176.1 5.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 72.13 110.901 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.1 p -145.97 10.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.157 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.74 -177.55 3.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.02 110.876 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.766 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 53.41 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.636 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.505 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 71.11 111.078 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.714 HG12 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 64.22 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.41 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 73.42 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.631 HG11 HD13 ' A' ' 117' ' ' LEU . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.517 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.414 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 71.5 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.526 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.2 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 64.24 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 73.3 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.612 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.766 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 61.3 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 61' ' ' GLU . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HG3' HD13 ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.932 HD22 ' HE ' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 70.54 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 71.21 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 63.13 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.932 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.46 ' CD2' HD22 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 73.11 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.779 HG21 HD21 ' A' ' 67' ' ' LEU . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 61.52 111.097 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 70.11 111.145 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.57 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 61.33 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.34 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.41 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.01 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.52 ' HB2' HD22 ' A' ' 144' ' ' LEU . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.634 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.564 ' SG ' HD21 ' A' ' 144' ' ' LEU . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.852 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.761 ' HB2' HD13 ' A' ' 123' ' ' LEU . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.41 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.456 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 41.41 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 63.41 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 64.41 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 61.44 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.714 ' CE2' HG12 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 72.32 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 52.05 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.62 ' O ' HG23 ' A' ' 118' ' ' VAL . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.412 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.631 HD13 HG11 ' A' ' 49' ' ' VAL . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 73.15 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 114' ' ' LYS . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.873 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 64.2 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.977 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.761 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 71.14 110.915 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 74.24 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 60.42 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.34 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.1 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.483 HG23 HH22 ' A' ' 73' ' ' ARG . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.661 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 63.04 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 45.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 79' ' ' TYR . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 71.13 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.564 HD21 ' SG ' ' A' ' 93' ' ' CYS . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.74 -65.84 0.26 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 65.1 m -116.31 44.86 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.837 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 45.12 -155.01 0.42 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.734 -0.746 . . . . 53.43 112.496 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 117.53 5.14 Favored 'Trans proline' 0 C--O 1.23 0.11 0 C-N-CA 122.72 2.28 . . . . 72.21 112.318 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 3.7 m -104.42 -48.81 3.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 63.01 110.847 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 35.6 t -87.15 86.03 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 62.45 110.816 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.783 -0.723 . . . . 61.14 112.537 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.465 -0.254 . . . . 61.45 112.465 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 t -130.66 127.75 39.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.865 0.364 . . . . 72.2 110.88 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.92 118.82 21.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 53.01 110.831 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.84 82.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 73.4 112.522 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -153.2 149.37 27.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.369 . . . . 52.21 110.829 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.08 170.9 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 63.32 110.786 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.57 83.51 0.72 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.787 -0.72 . . . . 60.54 112.471 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -85.96 154.07 21.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 73.13 110.809 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -134.67 89.11 2.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.076 -0.511 . . . . 64.35 110.905 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.4 t 55.42 164.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.223 -0.444 . . . . 51.01 110.869 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -138.46 -171.55 3.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 75.41 110.962 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 p -104.8 45.58 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.245 -0.434 . . . . 73.34 111.202 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -39.01 132.35 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 73.25 111.092 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 64.53 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.049 HG21 HG21 ' A' ' 120' ' ' THR . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.533 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 61.11 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.061 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 65.41 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 72.44 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -87.34 -175.72 5.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.763 ' O ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -66.26 -16.1 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 53.22 110.913 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 27.1 mt-10 34.87 -136.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 74.02 110.888 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 31' ' ' LYS . 4.5 p 59.51 10.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.114 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -152.59 118.55 5.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 65.03 110.902 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 41.23 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 63.54 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.699 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.882 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.468 HG23 HG22 ' A' ' 75' ' ' VAL . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 54.41 111.099 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.812 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.1 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.844 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 41.53 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 63.13 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.33 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.533 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 53.32 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.682 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.486 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.586 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 54.21 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' ILE . 2.6 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 71.11 110.889 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.97 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 70.03 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.699 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 71.43 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.586 ' HG3' HD13 ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 41.32 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.491 HD13 ' OG ' ' A' ' 97' ' ' SER . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 63.33 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.485 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 42.11 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.581 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.515 HH22 HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 71.22 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.468 HG22 HG23 ' A' ' 39' ' ' ILE . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 61.14 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.812 HG23 ' CE ' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.436 ' HD2' HD22 ' A' ' 140' ' ' LEU . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.594 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 70.24 110.914 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.505 ' CE ' HG21 ' A' ' 88' ' ' VAL . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 55.31 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' N ' ' A' ' 83' ' ' HIS . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.576 ' N ' HG12 ' A' ' 82' ' ' VAL . 46.8 m80 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 42.23 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 74.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.505 HG21 ' CE ' ' A' ' 80' ' ' LYS . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 73.51 111.089 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.2 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.725 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 53.23 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.471 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.12 112.318 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.705 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.25 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 51.41 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.791 ' HB2' HD13 ' A' ' 123' ' ' LEU . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 62.35 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.124 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.602 ' OG ' HD11 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 51.13 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' CYS . . . . . 0.442 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 74.24 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 73.32 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 62.23 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 44.13 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 72.15 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.844 ' CE2' HG12 ' A' ' 42' ' ' VAL . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 71.33 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 61.14 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 65.45 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 70.45 110.931 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.657 HG22 ' CD2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' THR . . . . . 1.049 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 72.31 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.061 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 71.2 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 64.22 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 43.42 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.697 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 71.54 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.23 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 HH22 ' A' ' 73' ' ' ARG . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 53.3 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 135' ' ' LEU . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 61.25 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.33 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.594 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' A' ' 91' ' ' PRO . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.1 -71.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 71.24 111.125 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.12 37.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 71.2 110.854 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -50.9 162.68 1.1 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.702 -0.761 . . . . 72.01 112.546 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.68 107.82 1.93 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.728 2.285 . . . . 75.12 112.362 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 94.5 p -133.05 132.0 41.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 74.23 110.885 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 97.6 p -122.32 106.36 11.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 65.24 110.841 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 C-N-CA 120.761 -0.733 . . . . 40.34 112.463 179.95 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.435 -0.266 . . . . 74.13 112.435 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 -48.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.845 0.355 . . . . 62.41 110.846 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.17 126.93 35.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 70.25 110.838 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.23 -113.98 1.39 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.701 -0.761 . . . . 62.11 112.484 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.1 p -101.09 177.33 4.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.968 0.413 . . . . 74.51 110.811 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -175.65 171.58 2.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.879 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.45 -154.51 8.9 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.775 -0.726 . . . . 64.13 112.48 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.84 177.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.812 0.339 . . . . 55.35 110.893 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.5 80.07 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 72.45 110.861 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -175.87 127.38 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 74.23 110.88 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.431 HD23 ' SD ' ' A' ' 108' ' ' MET . 9.5 mt -138.18 -177.52 4.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 72.42 110.941 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 12' ' ' VAL . 9.5 t -89.36 35.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 53.23 111.149 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' VAL . 7.4 p -36.47 134.73 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 53.22 111.114 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 1.01 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.948 HG21 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 41.51 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 53.15 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.783 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 54.22 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 61.53 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 64.15 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 62.33 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.127 HD13 ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.4 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.33 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 71.3 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.768 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.554 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -86.82 175.85 8.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.914 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -112.48 37.91 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.254 -0.43 . . . . 73.14 110.879 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HB3' ' ND2' ' A' ' 34' ' ' ASN . 9.7 mm-40 -100.59 -44.03 5.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 51.34 110.913 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.1 p 46.72 34.26 2.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 74.3 111.155 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.48 ' ND2' ' HB3' ' A' ' 32' ' ' GLU . 13.1 p30 -140.2 134.27 30.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 63.42 110.931 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 41.2 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.776 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.519 HG23 HG22 ' A' ' 75' ' ' VAL . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 61.41 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.783 ' HG2' HD11 ' A' ' 20' ' ' LEU . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 41.34 110.86 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.89 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 52.45 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 71.15 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.535 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 1.01 HG23 ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 42.43 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.416 HG12 ' CG ' ' A' ' 17' ' ' ASP . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 73.24 111.136 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.662 ' N ' HD12 ' A' ' 20' ' ' LEU . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 63.1 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.776 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 64.53 110.913 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.8 m120 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.885 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.01 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.476 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.476 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.2 110.796 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 73.23 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.566 HD21 HG21 ' A' ' 75' ' ' VAL . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 74.25 110.892 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 70.52 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PHE . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.566 HG21 HD21 ' A' ' 67' ' ' LEU . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.43 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.626 HG23 ' HE1' ' A' ' 40' ' ' MET . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 74.4 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.486 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 62.23 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.631 ' HB2' HD21 ' A' ' 140' ' ' LEU . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.44 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 63.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 83' ' ' HIS . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.438 ' N ' HG12 ' A' ' 82' ' ' VAL . 13.8 m80 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 72.34 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 64.14 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.647 ' CG ' HD13 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 71.22 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' CYS . . . . . 0.438 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' PHE . . . . . 0.63 ' CE1' HD12 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 72.33 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 51.34 111.12 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 50.14 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.44 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 61.35 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 65.35 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 63.41 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.431 ' SD ' HD23 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 65.03 110.811 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.535 ' HE1' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 70.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.89 ' CE2' HG12 ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 43.34 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 70.33 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.0 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.63 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.601 HG22 ' CG ' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.0 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 63.15 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.948 ' CG2' HG21 ' A' ' 16' ' ' VAL . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 1.127 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 61.33 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.469 HD13 ' HB2' ' A' ' 94' ' ' PHE . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.45 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 71.4 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.627 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 61.53 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.515 HG22 ' HB3' ' A' ' 134' ' ' ASP . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 64.45 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 42.01 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 71.3 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.515 ' HB3' HG22 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' TRP . . . . . 0.54 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.631 HD21 ' HB2' ' A' ' 79' ' ' TYR . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.14 110.92 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 65.52 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.54 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 63.21 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.647 HD13 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -47.59 -84.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.3 111.118 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 10.6 t -163.61 54.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 72.44 110.846 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -84.33 -156.63 24.73 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.702 -0.761 . . . . 52.34 112.457 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 6.59 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.609 2.206 . . . . 71.34 112.34 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.2 p -38.75 -46.02 1.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 73.42 110.888 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.9 t -41.47 159.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 70.52 110.841 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 53.34 112.464 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.798 0.332 . . . . 70.5 111.172 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.927 HG21 ' CG2' ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 72.44 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 65.52 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.41 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.142 HD13 ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 71.44 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 64.42 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.843 ' CD1' HD11 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 73.03 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.585 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 72.45 110.854 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 3.7 p-10 . . . . . 0 C--O 1.23 0.041 0 CA-C-O 120.833 0.349 . . . . 65.44 110.904 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 52.31 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 51.52 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.843 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 71.3 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.472 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.75 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 55.52 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 62.42 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.833 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 64.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 64.24 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 54.51 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.457 HG11 HD23 ' A' ' 117' ' ' LEU . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 73.43 111.109 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.463 ' C ' HD12 ' A' ' 20' ' ' LEU . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 65.34 111.144 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.62 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.04 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.809 ' HG3' HG23 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.452 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 62.33 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.44 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.983 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 72.11 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' HD23 ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.575 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 71.41 110.915 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.604 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 52.22 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.452 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 51.21 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.947 HD21 HG21 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.12 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 114' ' ' LYS . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 HD21 ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.75 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.33 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 61.12 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.04 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.605 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 64.22 111.162 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG22 ' A' ' 82' ' ' VAL . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.23 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 63.31 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.605 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 50.01 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 61.31 110.894 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.906 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 73.1 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 71.44 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 43.21 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 34.5 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 52.23 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 72.0 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 61.2 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 62.54 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.499 ' N ' ' O ' ' A' ' 106' ' ' GLN . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 52.04 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.833 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.04 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 71.22 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.417 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.13 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.927 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.142 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 94' ' ' PHE . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.915 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 72.11 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 64.21 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 71.13 111.146 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.583 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.34 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 35.21 110.954 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 71.34 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 53.34 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.417 HG22 ' HG3' ' A' ' 142' ' ' GLU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.73 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.04 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.73 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 50.1 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.417 ' HG3' HG22 ' A' ' 138' ' ' THR . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.583 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.03 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 65.0 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.422 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.5 p . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.869 0.366 . . . . 71.31 111.106 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' N ' HG22 ' A' ' 13' ' ' VAL . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.885 HG21 HG21 ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.2 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 65.43 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 70.42 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 40' ' ' MET . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 73.3 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 63.53 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.23 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 71.32 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CD2' HD21 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 33.21 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 70.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 71.14 110.848 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 63.1 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 64.14 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 72.25 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.81 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.53 110.861 179.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.759 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 64.43 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 62.42 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 41.11 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 54' ' ' GLU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.1 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.729 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.456 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.965 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 63.35 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 53.53 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 64.42 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.685 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 65.22 110.891 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.456 ' HG3' HD13 ' A' ' 55' ' ' LEU . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.12 110.901 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 43.12 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 63.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.424 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.572 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.612 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 65.12 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.81 HG23 ' HE1' ' A' ' 40' ' ' MET . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.05 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 71.01 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.507 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.751 HG23 ' HB ' ' A' ' 88' ' ' VAL . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 53.53 111.152 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.436 ' H ' HG22 ' A' ' 82' ' ' VAL . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 61.34 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.751 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.21 111.113 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 64.0 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 72.43 110.882 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.468 ' HB2' HD22 ' A' ' 144' ' ' LEU . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.773 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.11 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.414 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 74.13 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 61.32 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 70.21 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 73.53 112.314 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 52.45 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 71.1 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.759 ' CE2' HG12 ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 45.04 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 45.24 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.628 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 63.53 110.893 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 64.1 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 63.1 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.724 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 70.32 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 114' ' ' LYS . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.885 HG21 HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 61.44 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 73.41 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.402 HG13 ' HD2' ' A' ' 94' ' ' PHE . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.526 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 71.33 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 62.43 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.452 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.23 110.927 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 62.51 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 142' ' ' GLU . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.89 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.89 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.15 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.51 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.468 HD22 ' HB2' ' A' ' 91' ' ' PRO . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.793 0.33 . . . . 65.14 111.161 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 63.11 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 62.12 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.493 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.11 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.473 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.9 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 55.14 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.781 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 73.32 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.835 0.35 . . . . 65.33 110.917 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.44 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.874 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.543 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.685 HG21 ' CZ ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.674 ' CE ' HG23 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.776 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 71.52 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.881 HG11 HD13 ' A' ' 117' ' ' LEU . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.432 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.816 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 65.32 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.55 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.816 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.504 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.937 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.499 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 61.42 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.894 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.874 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 62.45 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.73 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.13 110.83 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.73 HD22 ' HG2' ' A' ' 64' ' ' LYS . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.872 HD21 HG21 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 44.53 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.02 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.451 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 52.1 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.56 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 31.21 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.685 ' CZ ' HG21 ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.872 HG21 HD21 ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 73.45 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.674 HG23 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.45 ' HD1' ' HB2' ' A' ' 37' ' ' ALA . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 53.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 63.43 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 74.3 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 72.32 111.154 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.828 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 51.4 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 60.53 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 88' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 55.1 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.781 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 144' ' ' LEU . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.755 ' CD1' HG22 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 77' ' ' TYR . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 63.55 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 53.13 110.892 -179.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 55.04 112.312 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.451 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 61.12 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.776 ' CE2' HG12 ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 71.22 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 61.12 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 72.4 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 70.11 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 118' ' ' VAL . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.03 110.847 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 55.43 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.881 HD13 HG11 ' A' ' 49' ' ' VAL . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.755 HG22 ' CD1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 64.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.71 HG21 HG21 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.9 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 52.15 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 94' ' ' PHE . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 62.02 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.0 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.567 ' CG2' HG11 ' A' ' 118' ' ' VAL . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.464 ' HE2' ' HG ' ' A' ' 93' ' ' CYS . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.401 HG22 ' HB3' ' A' ' 134' ' ' ASP . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 63.52 111.067 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.5 HG22 ' HB2' ' A' ' 67' ' ' LEU . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.894 HD22 ' O ' ' A' ' 60' ' ' PRO . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 50.5 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 70.41 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 93' ' ' CYS . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.43 111.099 179.815 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.763 0.316 . . . . 73.23 111.179 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 55.13 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 50.41 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 60.43 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.559 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.067 HD13 ' HB2' ' A' ' 121' ' ' ALA . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.822 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 53.23 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.0 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.871 0.367 . . . . 64.0 110.855 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 53.25 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 71.14 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 ' CG ' ' A' ' 54' ' ' GLU . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.576 ' CG1' HG22 ' A' ' 75' ' ' VAL . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 63.41 111.101 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.835 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 4.0 mm-40 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 50.45 110.928 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.35 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.789 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.789 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 72.15 110.896 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.33 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.456 ' O ' HG22 ' A' ' 58' ' ' ILE . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 62.54 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.955 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.491 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 65.53 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 52.03 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.405 ' OE2' HD12 ' A' ' 65' ' ' LEU . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 73.52 110.858 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.632 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 71.2 110.875 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.405 HD12 ' OE2' ' A' ' 62' ' ' GLU . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.49 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 52.01 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.88 HD21 HG21 ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 62.02 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 54.24 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.408 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 63.3 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 72.22 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.57 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 62.43 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 72.14 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.88 HG21 HD21 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 63.25 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.835 HG23 ' HE1' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 62.14 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.524 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.428 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 71.44 111.133 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 63.2 110.858 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 81' ' ' TYR . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 72.25 111.146 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.822 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.03 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 62.34 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.441 ' HA ' HD11 ' A' ' 129' ' ' ILE . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 53.21 110.858 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 51.1 110.862 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 71.12 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 64.34 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 25.35 112.539 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 71.15 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.12 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 63.01 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.686 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 65.03 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 70.44 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 43.43 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.067 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 61.34 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 71.24 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 64.51 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 71.25 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 54.51 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 63.11 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 63.5 110.918 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 64.42 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 64.12 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 62.03 110.925 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.31 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 73.32 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 142' ' ' GLU . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.799 ' O ' HD22 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 74.34 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.763 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 65.2 110.891 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.514 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 62.43 110.924 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 71.42 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.099 179.845 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.425 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.4 p . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.78 0.324 . . . . 73.54 111.149 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.425 ' N ' HG22 ' A' ' 13' ' ' VAL . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.794 HG21 HG21 ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 73.43 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.696 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 60.04 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 52.11 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.041 HD13 ' HB2' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 70.44 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.766 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 72.33 110.92 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.861 0.363 . . . . 64.22 110.87 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.085 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.466 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 54.11 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 61.54 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.749 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 65.02 110.906 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.789 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.14 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 71.5 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.422 HG11 ' HG ' ' A' ' 117' ' ' LEU . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' OD2' ' A' ' 17' ' ' ASP . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.096 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.696 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 73.43 110.848 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.48 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.5 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.1 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.95 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.24 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.503 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 50.01 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 64.12 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.34 110.894 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 70.33 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.48 ' HG3' HD13 ' A' ' 55' ' ' LEU . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.753 HD21 HG21 ' A' ' 75' ' ' VAL . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 62.1 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.753 HG21 HD21 ' A' ' 67' ' ' LEU . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 50.32 111.111 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.749 HG23 ' HE1' ' A' ' 40' ' ' MET . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 64.12 111.109 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 64.12 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 73.23 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.32 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.505 HG22 ' N ' ' A' ' 83' ' ' HIS . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 54.13 111.065 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.505 ' N ' HG22 ' A' ' 82' ' ' VAL . 17.6 m-70 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 63.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 73.01 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 71.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 82' ' ' VAL . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.2 111.106 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 51.2 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 71.44 112.381 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.766 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.41 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 64.35 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.545 ' CG ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 70.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.482 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 65.41 111.015 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 74.45 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 52.44 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 61.51 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 54.21 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.789 ' CE2' HG12 ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.33 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 51.12 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 62.15 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.482 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.495 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.898 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.545 HG22 ' CG ' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 45.43 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.794 HG21 HG21 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.041 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 64.23 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' PHE . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 32.42 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 65.22 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 61.13 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 62.25 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 70.43 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 63.45 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.693 HD13 ' N ' ' A' ' 141' ' ' LYS . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 62.31 110.984 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.693 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.33 110.924 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 62.01 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.845 0.355 . . . . 75.32 111.148 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 16' ' ' VAL . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.43 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.605 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.22 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.966 HD13 ' HB2' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 55.31 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.737 ' CD2' HD21 ' A' ' 92' ' ' LEU . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 64.03 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.21 110.804 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.847 0.356 . . . . 54.23 110.9 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.412 HD11 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 63.34 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.684 ' SD ' HD21 ' A' ' 117' ' ' LEU . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 53.4 110.878 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.864 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 64.54 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 63.33 110.964 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.408 ' CG ' HG13 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.439 HG11 HD13 ' A' ' 117' ' ' LEU . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 52.24 111.187 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 63.44 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 64.23 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 71.14 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 72.21 110.869 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 51' ' ' LEU . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.405 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 9.3 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 51.15 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.96 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 72.03 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.481 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 55.04 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.618 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 64.54 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 71.41 110.87 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.493 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.493 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 73.35 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 41.31 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.623 HG23 ' HE1' ' A' ' 40' ' ' MET . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 72.44 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.401 ' HB2' HD21 ' A' ' 140' ' ' LEU . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 88' ' ' VAL . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 20.5 m-70 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 82' ' ' VAL . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.22 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.42 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.737 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.499 ' SG ' HD21 ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.588 ' HB2' HD13 ' A' ' 123' ' ' LEU . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 52.33 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 60.13 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 62.41 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.22 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.864 ' CE2' HG12 ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 50.01 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 61.34 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 64.3 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.59 HG11 HG21 ' A' ' 126' ' ' VAL . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 72.12 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.644 HG21 HG21 ' A' ' 16' ' ' VAL . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.966 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.476 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 94' ' ' PHE . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 52.21 110.964 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.59 HG21 HG11 ' A' ' 118' ' ' VAL . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 71.23 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 72.52 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 52.11 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 65.2 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.618 HD21 ' HB3' ' A' ' 63' ' ' LEU . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.461 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 71.32 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 64.32 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 63.51 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.575 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.127 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.7 t . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 72.43 111.149 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.13 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 63.45 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 60.13 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 61.2 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.664 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 64.14 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.475 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.066 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.768 0.318 . . . . 72.43 110.884 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 70.1 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.766 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.34 110.881 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.861 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 71.45 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 60.42 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 63.24 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.784 HD11 ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 42.1 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.4 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.784 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 52.52 110.912 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.484 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.24 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.484 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.961 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 62.03 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.492 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 73.32 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.492 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.898 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' HD13 ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.34 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.849 HD21 HG21 ' A' ' 75' ' ' VAL . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.437 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 62.21 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.437 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 63.35 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.403 ' CD2' HD22 ' A' ' 117' ' ' LEU . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.849 HG21 HD21 ' A' ' 67' ' ' LEU . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 60.01 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.766 HG23 ' HE1' ' A' ' 40' ' ' MET . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.507 ' HB2' HD12 ' A' ' 95' ' ' ILE . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.932 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 83' ' ' HIS . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.427 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.0 m-70 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 71.0 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 74.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 123' ' ' LEU . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 72.52 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 77' ' ' TYR . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 73.22 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.446 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 52.14 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 62.34 110.898 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.03 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 71.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 52.42 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 72.34 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.861 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.534 ' O ' HG23 ' A' ' 118' ' ' VAL . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 62.14 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 65.4 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HG22 ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 114' ' ' LYS . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 70.3 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 64.13 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 72.55 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.066 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 50.31 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 94' ' ' PHE . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.918 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 55.04 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 71.15 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.14 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 54.24 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 52.42 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 73.24 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 65.2 110.954 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 71.33 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.474 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 142' ' ' GLU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.14 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.769 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.769 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.01 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 64.34 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 70.42 111.133 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.809 0.338 . . . . 74.3 111.136 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 1.026 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 54.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.949 HG21 HG21 ' A' ' 120' ' ' THR . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 73.22 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 72.22 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 65.4 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.08 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 55.1 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.719 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 62.25 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 73.44 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.429 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.816 0.341 . . . . 61.44 110.879 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 72.3 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 62.2 111.137 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.547 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 64.51 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.722 ' HG2' HD11 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 61.22 110.871 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 71.45 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.614 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 65.04 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 51.15 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 73.33 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.462 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 1.026 HG23 ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.462 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.633 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 61.34 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.547 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 HD13 ' HG3' ' A' ' 66' ' ' GLU . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 43.4 110.898 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.948 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 65.21 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 43.24 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 62.35 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.639 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 61.1 110.908 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 61.14 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG3' HD13 ' A' ' 55' ' ' LEU . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.867 HD21 HG21 ' A' ' 75' ' ' VAL . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 71.43 110.958 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 62.22 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 55.24 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.581 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.572 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.867 HG21 HD21 ' A' ' 67' ' ' LEU . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 53.13 111.171 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.695 HG23 ' HE1' ' A' ' 40' ' ' MET . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 70.24 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.591 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.574 ' N ' HG12 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 71.21 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.13 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 72.52 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.719 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 64.42 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.852 ' HB2' HD13 ' A' ' 123' ' ' LEU . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 64.01 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.24 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 52.54 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 55.21 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 55.2 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.614 ' CE2' HG12 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.117 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 34.22 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 61.31 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 64.11 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 HG11 ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.531 HG22 ' CG ' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 64.41 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.949 HG21 HG21 ' A' ' 16' ' ' VAL . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 55.42 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.08 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.437 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.852 HD13 ' HB2' ' A' ' 94' ' ' PHE . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.734 HG13 ' HD2' ' A' ' 94' ' ' PHE . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.567 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.582 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 63.03 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 63.51 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 74.21 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 61.13 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.582 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.639 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 65.21 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 71.35 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 73.2 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.591 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.567 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 140' ' ' LEU . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 72.31 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.1 t . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.835 0.35 . . . . 73.31 111.177 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 41.43 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.915 HG21 HG21 ' A' ' 120' ' ' THR . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 45.02 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 64.41 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.703 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.24 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.107 HD13 ' HB2' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 50.33 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 64.51 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.21 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 72.25 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.4 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 C--O 1.23 0.05 0 CA-C-O 120.851 0.358 . . . . 65.53 110.877 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 70.34 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 64.31 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.476 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 74.41 111.131 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 60.3 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.758 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.756 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 70.34 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 35.05 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 73.12 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.414 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.14 110.905 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.414 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.975 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 71.43 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.501 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.501 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.53 ' O ' HD13 ' A' ' 65' ' ' LEU . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 42.31 110.897 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 63.42 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.674 HD21 HG21 ' A' ' 75' ' ' VAL . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 51.23 110.91 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.481 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 55.25 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.554 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 42.21 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 70.13 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.674 HG21 HD21 ' A' ' 67' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.32 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.758 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.496 HG12 ' N ' ' A' ' 83' ' ' HIS . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 61.21 111.154 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.496 ' N ' HG12 ' A' ' 82' ' ' VAL . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 70.04 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 44.11 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.24 112.345 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.938 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.658 ' HB2' HD13 ' A' ' 123' ' ' LEU . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 70.44 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 71.12 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 52.31 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 72.41 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 50.35 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.756 ' CE2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 71.45 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 71.32 112.494 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 54.14 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 52.22 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.633 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.549 HG22 ' CG ' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.915 HG21 HG21 ' A' ' 16' ' ' VAL . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 61.24 111.155 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.107 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 51.21 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.438 HG23 ' HG3' ' A' ' 125' ' ' LYS . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.438 ' HG3' HG23 ' A' ' 124' ' ' THR . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' A' ' 94' ' ' PHE . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 62.4 111.104 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 72.42 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 71.23 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 63.02 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 72.24 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 62.25 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.55 HG22 ' HG3' ' A' ' 142' ' ' GLU . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 62.43 111.136 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 61.24 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.796 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 60.13 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.55 ' HG3' HG22 ' A' ' 138' ' ' THR . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 61.54 110.821 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.585 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.777 0.322 . . . . 70.45 111.178 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 45.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 71.15 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.03 HG21 HG21 ' A' ' 120' ' ' THR . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 73.44 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 51' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.13 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.54 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 72.11 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 72.53 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.776 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.55 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 65.12 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.795 0.331 . . . . 62.34 110.857 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.473 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.746 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 64.33 110.864 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.831 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 72.2 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.406 ' CG ' ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HG3' ' CG ' ' A' ' 45' ' ' ASP . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 72.11 110.885 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 62.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.448 HG11 HD23 ' A' ' 117' ' ' LEU . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 52.01 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.735 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.425 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 53.21 110.91 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.05 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.963 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 73.45 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 61.23 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 61.53 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.644 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 64.2 110.934 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 72.13 110.894 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.758 HD21 HG21 ' A' ' 75' ' ' VAL . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.419 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 54.51 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.456 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.758 HG21 HD21 ' A' ' 67' ' ' LEU . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 64.14 111.106 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.746 HG23 ' CE ' ' A' ' 40' ' ' MET . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.49 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 72.43 110.936 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.546 ' HB2' HD21 ' A' ' 140' ' ' LEU . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.23 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 64.42 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.523 ' N ' HG12 ' A' ' 82' ' ' VAL . 26.5 m-70 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 73.23 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 53.11 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.41 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.776 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 52.42 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 60.44 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.612 ' CG ' HG22 ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.49 HD12 ' HB2' ' A' ' 77' ' ' TYR . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 65.44 111.116 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.574 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 52.22 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.12 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.419 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 73.2 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.3 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.831 ' CE2' HG12 ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.574 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.472 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 53.4 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 71.54 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 1.03 HG21 HG21 ' A' ' 16' ' ' VAL . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 54.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 62.52 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 94' ' ' PHE . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 63.32 110.965 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 52.15 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 71.01 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.61 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 63.24 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 52.04 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.644 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 61.32 110.85 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 45.2 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 63.05 110.853 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 64.11 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.628 HD13 ' HG2' ' A' ' 91' ' ' PRO . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.233 0.202 0 CA-C-O 120.824 0.345 . . . . 52.31 111.174 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.06 HG21 HG21 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.45 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 64.52 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.493 ' O ' HD23 ' A' ' 20' ' ' LEU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 51.55 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 63.12 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.98 HD13 ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 61.11 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 72.44 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 43.04 110.926 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 120.805 0.336 . . . . 75.41 110.901 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 62.15 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.506 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 61.23 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.45 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG23 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 62.35 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.02 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.88 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 63.25 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 63.4 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 117' ' ' LEU . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.425 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 52.33 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 65.12 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 54.33 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.698 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 64.14 110.838 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.444 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.9 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.981 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.49 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.685 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 74.32 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.12 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.657 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 73.5 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.523 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 73.32 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.431 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 64.33 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.431 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.45 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 62.53 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 1.043 HG21 HD21 ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 45.4 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 76' ' ' VAL . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 61.31 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 73.53 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 72.21 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 72.31 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 51.45 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 81' ' ' TYR . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.508 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.05 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 61.33 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.72 ' CE1' HD12 ' A' ' 117' ' ' LEU . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 62.44 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.441 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 61.04 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 62.25 110.875 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.416 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 53.35 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 60.34 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 71.21 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 74.53 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 71.53 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.88 ' CE2' HG12 ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 55.03 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.72 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.688 HG22 ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 73.33 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 61.52 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 1.06 HG21 HG21 ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 63.11 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.98 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.575 HD13 ' HB2' ' A' ' 94' ' ' PHE . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.858 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.638 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.109 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 71.35 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.592 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 71.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.596 HG23 ' OD1' ' A' ' 134' ' ' ASP . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 60.45 111.126 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.04 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 53.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.596 ' OD1' HG23 ' A' ' 131' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.685 HD22 ' O ' ' A' ' 60' ' ' PRO . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 71.3 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.592 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.767 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.767 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 62.02 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.454 HD13 ' HG2' ' A' ' 91' ' ' PRO . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 55.43 111.12 179.787 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.813 0.339 . . . . 51.2 111.125 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 53.3 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 72.32 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 70.3 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 63.51 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 70.4 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.772 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 72.23 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.83 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 . . . . . 0 C--O 1.23 0.036 0 CA-C-O 120.788 0.327 . . . . 74.1 110.875 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 61.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 60.34 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.589 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 62.32 111.101 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.776 ' CE ' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.76 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 65.52 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 71.52 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.418 HG11 HD13 ' A' ' 117' ' ' LEU . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 54.04 111.14 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.401 HG12 ' OD2' ' A' ' 17' ' ' ASP . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.472 HD13 ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 70.35 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.451 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 63.4 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.451 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.951 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.633 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 70.01 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 65.42 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.413 ' CD2' HG21 ' A' ' 75' ' ' VAL . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.479 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 52.22 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' PRO . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 64.12 110.991 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.424 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.479 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CD2' HD22 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 67' ' ' LEU . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.211 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.776 HG23 ' CE ' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.587 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.02 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.452 HG13 ' HB ' ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 62.21 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 74.42 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 55.42 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.452 ' HB ' HG13 ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.496 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.772 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 70.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.5 ' SG ' HD21 ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 71.23 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.32 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 71.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 61.55 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 70.22 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.483 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.76 ' CE2' HG12 ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 61.41 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 54.53 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.3 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.559 HD22 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 74.55 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.439 HG22 ' CD1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.718 HG21 HG21 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 71.31 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 52.55 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 64.4 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.23 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.633 HD21 ' HB3' ' A' ' 63' ' ' LEU . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.22 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 62.14 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 79' ' ' TYR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 71.42 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 72.52 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 64.33 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 61.13 111.089 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.824 0.345 . . . . 41.42 111.159 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.803 HG21 HG21 ' A' ' 120' ' ' THR . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 63.23 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.13 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 44.53 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 62.44 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 71.41 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.085 HD13 ' HB2' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 63.34 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 71.41 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 53.51 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.8 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.841 0.353 . . . . 72.1 110.9 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.831 HG23 ' CG ' ' A' ' 54' ' ' GLU . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.42 HG12 HG22 ' A' ' 75' ' ' VAL . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.678 ' HE1' HG23 ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.2 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 73.33 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.847 HG11 HD13 ' A' ' 117' ' ' LEU . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 65.31 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 62.34 110.919 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.413 ' CG ' ' O ' ' A' ' 52' ' ' GLU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.831 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.559 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 65.55 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.495 ' O ' HG22 ' A' ' 58' ' ' ILE . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.984 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 71.54 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.685 ' O ' HD13 ' A' ' 65' ' ' LEU . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.53 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HG2' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 61' ' ' GLU . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.559 ' HG3' HD13 ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 1.008 HD21 HG21 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.501 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 61.54 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.583 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 53.44 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.902 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.491 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.2 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 1.008 HG21 HD21 ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 51.52 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.678 HG23 ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.451 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.722 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 62.11 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.566 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 64.04 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.433 HG21 ' HE2' ' A' ' 80' ' ' LYS . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 63.01 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.561 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 44.33 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.413 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.8 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 71.14 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.506 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 55.11 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.581 ' HD2' HG23 ' A' ' 126' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 70.42 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.484 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 64.11 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.599 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 72.05 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.23 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.33 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 63.01 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 61.13 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 44.34 112.458 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.591 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.12 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.52 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 49' ' ' VAL . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 114' ' ' LYS . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 73.41 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.803 HG21 HG21 ' A' ' 16' ' ' VAL . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 64.13 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.085 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 52.42 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.581 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 73.23 111.121 179.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 63.22 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.534 HG22 ' HB3' ' A' ' 134' ' ' ASP . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.54 111.134 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 65.54 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.52 HG23 HH22 ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.534 ' HB3' HG22 ' A' ' 129' ' ' ILE . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 50.02 110.884 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.419 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' A' ' 79' ' ' TYR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 71.13 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.538 HD11 HD11 ' A' ' 140' ' ' LEU . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.759 0.314 . . . . 75.41 111.127 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 HG21 ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 32.42 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.492 ' OD2' HG12 ' A' ' 50' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.51 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 61.13 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.01 HD13 ' HB2' ' A' ' 121' ' ' ALA . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 64.53 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 71.42 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.499 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.852 0.358 . . . . 53.23 110.89 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 54.45 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 35.05 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.616 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 HG22 ' A' ' 75' ' ' VAL . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 64.42 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.838 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 52.14 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 52.3 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.4 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.25 110.894 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.879 HG11 HD13 ' A' ' 117' ' ' LEU . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' OD2' ' A' ' 17' ' ' ASP . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 71.32 111.144 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 64.42 110.896 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.412 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 72.42 110.975 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 63.33 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.928 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.644 ' O ' HD13 ' A' ' 65' ' ' LEU . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 55' ' ' LEU . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.781 HD21 HG21 ' A' ' 75' ' ' VAL . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 70.33 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.452 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 53.42 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.579 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.452 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.658 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.781 HG21 HD21 ' A' ' 67' ' ' LEU . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.405 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.906 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 61.43 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 65.34 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.455 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 72.52 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 72.23 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.404 ' HB ' HG13 ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.15 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.418 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.602 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.473 ' HB2' HD13 ' A' ' 123' ' ' LEU . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 62.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.439 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 52.13 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 71.34 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 65.13 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 70.22 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.838 ' CE2' HG12 ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 71.4 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 72.03 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 73.45 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.879 HD13 HG11 ' A' ' 49' ' ' VAL . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.24 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.903 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 54.02 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.01 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 65.2 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 62.42 110.936 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 72.21 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 65.42 110.952 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.558 HG22 ' HG3' ' A' ' 142' ' ' GLU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.23 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.642 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.642 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 71.21 110.891 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.558 ' HG3' HG22 ' A' ' 138' ' ' THR . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 63.42 110.886 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 62.42 111.043 179.813 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.83 0.348 . . . . 61.11 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.99 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.816 HG11 HG21 ' A' ' 120' ' ' THR . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 70.0 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 40' ' ' MET . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.35 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 71.03 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.007 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 62.41 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.738 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.458 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 64.44 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 64.13 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 64.1 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.867 0.365 . . . . 73.22 110.865 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 60.22 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 53.15 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 53.3 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.433 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 71.53 111.155 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.79 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.945 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 62.13 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.725 ' NH2' HG21 ' A' ' 50' ' ' VAL . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 61.13 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 48' ' ' MET . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 72.52 110.905 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.99 HG23 ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.725 HG21 ' NH2' ' A' ' 46' ' ' ARG . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.734 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.437 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 73.2 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.441 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.986 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.563 ' O ' HD13 ' A' ' 65' ' ' LEU . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 60.14 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.692 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 72.22 110.974 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 61' ' ' GLU . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.11 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.66 HD21 HG21 ' A' ' 75' ' ' VAL . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 63.24 110.874 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.485 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 51.45 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 72.43 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.485 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.66 HG21 HD21 ' A' ' 67' ' ' LEU . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 65.34 111.175 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.79 HG23 ' CE ' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.565 ' HB2' HD12 ' A' ' 95' ' ' ILE . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.547 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 50.11 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.667 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.513 HG13 ' HB ' ' A' ' 88' ' ' VAL . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 53.5 111.207 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.422 ' N ' HG12 ' A' ' 82' ' ' VAL . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 60.14 110.899 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 52.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 44.12 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 81' ' ' TYR . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 54.44 111.158 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 62.1 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.547 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 72.24 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.738 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 54.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.565 ' CZ ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 64.44 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.565 HD12 ' HB2' ' A' ' 77' ' ' TYR . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.23 111.133 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.496 ' HA ' HD11 ' A' ' 129' ' ' ILE . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.14 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 73.35 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 73.35 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 62.44 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.33 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.434 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.945 ' CE2' HG12 ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 62.23 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.751 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.565 HG22 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.816 HG21 HG11 ' A' ' 16' ' ' VAL . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.007 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.51 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . 0.538 HG23 ' HG2' ' A' ' 125' ' ' LYS . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 62.24 111.116 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' A' ' 124' ' ' THR . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 HG11 ' A' ' 118' ' ' VAL . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 73.23 111.147 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.02 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.594 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 52.15 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 71.43 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.692 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.528 HG22 ' HG3' ' A' ' 142' ' ' GLU . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 61.1 111.148 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.72 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.72 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.528 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 62.42 110.924 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 71.43 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 23.53 111.14 179.744 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.874 0.369 . . . . 74.45 111.063 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.05 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 70.03 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.726 HG21 HG21 ' A' ' 120' ' ' THR . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 53.31 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.487 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 72.31 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 62.2 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.062 0 CA-C-O 120.842 0.353 . . . . 65.31 110.859 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 55.35 111.072 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.484 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 60.5 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 ' CG ' ' A' ' 54' ' ' GLU . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.569 HG23 ' HG3' ' A' ' 73' ' ' ARG . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 64.11 111.145 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.535 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 51.21 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.883 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 70.33 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 43.21 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.667 HG11 HD13 ' A' ' 117' ' ' LEU . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.487 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 62.24 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 20' ' ' LEU . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.635 ' N ' HD23 ' A' ' 51' ' ' LEU . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.465 ' N ' HD23 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.409 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.519 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 52.03 110.952 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.991 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 71.05 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.512 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.512 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' HD23 ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 61.21 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 72.32 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.736 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.558 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 55' ' ' LEU . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.888 HD22 ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 63.11 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.486 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.423 ' HB2' ' NH1' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.423 ' NH1' ' HB2' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' PRO . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 55.05 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.888 ' NH1' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 73.0 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.623 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 61.43 111.117 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.535 HG23 ' HE1' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 63.34 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.641 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 70.12 111.13 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 22.6 m-70 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 34.41 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.13 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.641 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 64.41 111.143 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 63.45 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 45.54 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.514 ' CG ' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 61.11 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.558 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.449 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 62.15 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 63.23 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 71.43 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 64.24 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 53.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 73.41 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.413 ' N ' ' O ' ' A' ' 106' ' ' GLN . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 70.12 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.883 ' CE2' HG12 ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 65.13 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 63.24 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.558 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.667 HD13 HG11 ' A' ' 49' ' ' VAL . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.514 HG22 ' CG ' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 44.31 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.726 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 65.14 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 62.41 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 54.41 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 64.45 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 70.25 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.489 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 64.44 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.736 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 71.3 110.939 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 64.24 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 61.01 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 70.11 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.34 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.573 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 54.14 111.107 179.812 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.888 0.375 . . . . 72.51 111.098 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.0 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 52.31 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 62.4 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.784 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 51' ' ' LEU . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.942 HD13 ' HB2' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.744 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 65.11 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 71.15 110.882 -179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 . . . . . 0 C--O 1.23 0.053 0 CA-C-O 120.807 0.337 . . . . 74.51 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 64.05 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.4 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.516 HG23 ' HG3' ' A' ' 73' ' ' ARG . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 71.4 111.142 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.786 ' CE ' HG23 ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 64.5 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.778 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 72.31 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 73.33 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 71.3 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 51.34 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 52.33 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HB3' HG22 ' A' ' 39' ' ' ILE . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 51.45 110.864 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.4 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 62.54 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' HG22 ' A' ' 58' ' ' ILE . 9.9 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.03 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.93 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.02 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.502 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.502 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.633 ' O ' HD23 ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.929 179.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.633 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 54.21 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.765 HD13 HH12 ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.13 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.487 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.416 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.765 HH12 HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.5 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 117' ' ' LEU . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 43.23 111.154 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.786 HG23 ' CE ' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 60.24 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 60.45 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 72.04 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 83' ' ' HIS . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 72.34 111.168 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.475 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 41.21 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 65.12 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.744 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.627 ' CD1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 65.12 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.56 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.429 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 41.22 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.416 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 62.24 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 65.04 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.778 ' CE2' HG12 ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 65.25 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.603 HD21 ' SD ' ' A' ' 40' ' ' MET . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.627 HG22 ' CD1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 65.52 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.4 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.942 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 71.51 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.479 HD13 ' CD1' ' A' ' 94' ' ' PHE . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 54.51 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.494 HG22 HG11 ' A' ' 118' ' ' VAL . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.4 111.105 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 63.53 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.14 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.415 ' O ' HG23 ' A' ' 136' ' ' THR . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.56 HD12 ' C ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 65.44 110.929 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 50.21 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.464 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 62.51 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 70.54 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 55.32 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 44.32 111.155 179.783 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.851 0.358 . . . . 61.0 111.133 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.873 HG21 HG21 ' A' ' 120' ' ' THR . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 61.51 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.517 ' CG ' HG12 ' A' ' 50' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.23 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 40.25 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.663 HD21 HD21 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 51' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 55.12 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.977 HD13 ' HB2' ' A' ' 121' ' ' ALA . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.636 ' CD1' HD11 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 61.1 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 65.14 110.867 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 N--CA 1.458 -0.039 0 CA-C-O 120.85 0.357 . . . . 74.02 110.876 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.766 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 53.41 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.636 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.505 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 71.11 111.078 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.714 HG12 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 64.22 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.41 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 73.42 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.631 HG11 HD13 ' A' ' 117' ' ' LEU . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.517 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.414 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 71.5 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.526 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 64.24 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 73.3 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.612 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.766 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 61.3 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 61' ' ' GLU . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HG3' HD13 ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.932 HD22 ' HE ' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 70.54 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 71.21 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 63.13 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.932 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.46 ' CD2' HD22 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 73.11 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.779 HG21 HD21 ' A' ' 67' ' ' LEU . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 61.52 111.097 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 70.11 111.145 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.57 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 61.33 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.34 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.41 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.01 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.52 ' HB2' HD22 ' A' ' 144' ' ' LEU . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.634 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.564 ' SG ' HD21 ' A' ' 144' ' ' LEU . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.852 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.761 ' HB2' HD13 ' A' ' 123' ' ' LEU . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.41 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.456 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 41.41 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 63.41 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 64.41 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 61.44 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.714 ' CE2' HG12 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 72.32 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 52.05 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.62 ' O ' HG23 ' A' ' 118' ' ' VAL . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.412 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.631 HD13 HG11 ' A' ' 49' ' ' VAL . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 73.15 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 114' ' ' LYS . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.873 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 64.2 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.977 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.761 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 71.14 110.915 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 74.24 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 60.42 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.34 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.1 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.483 HG23 HH22 ' A' ' 73' ' ' ARG . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.661 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 63.04 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 45.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 79' ' ' TYR . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 71.13 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.564 HD21 ' SG ' ' A' ' 93' ' ' CYS . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.807 0.337 . . . . 73.25 111.092 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 64.53 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.049 HG21 HG21 ' A' ' 120' ' ' THR . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.533 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.682 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 61.11 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.061 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 65.41 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 72.44 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.36 . . . . 65.03 110.902 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 41.23 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 63.54 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.699 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.882 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.468 HG23 HG22 ' A' ' 75' ' ' VAL . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 54.41 111.099 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.812 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.1 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.844 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 41.53 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 63.13 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.33 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.533 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 53.32 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.682 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.486 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.586 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 54.21 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' ILE . 7.8 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 71.11 110.889 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.97 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 70.03 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.699 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 71.43 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.586 ' HG3' HD13 ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 41.32 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.491 HD13 ' OG ' ' A' ' 97' ' ' SER . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 63.33 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.485 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 42.11 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.581 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.515 HH22 HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 71.22 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.468 HG22 HG23 ' A' ' 39' ' ' ILE . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 61.14 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.812 HG23 ' CE ' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.436 ' HD2' HD22 ' A' ' 140' ' ' LEU . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.594 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 70.24 110.914 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.505 ' CE ' HG21 ' A' ' 88' ' ' VAL . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 55.31 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' N ' ' A' ' 83' ' ' HIS . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.576 ' N ' HG12 ' A' ' 82' ' ' VAL . 33.2 m-70 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 42.23 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 74.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.505 HG21 ' CE ' ' A' ' 80' ' ' LYS . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 73.51 111.089 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.2 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 53.23 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.471 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.12 112.318 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.705 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.25 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 51.41 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.791 ' HB2' HD13 ' A' ' 123' ' ' LEU . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 62.35 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.124 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.602 ' OG ' HD11 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 51.13 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . 0.442 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 74.24 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 73.32 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 62.23 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 44.13 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 72.15 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.844 ' CE2' HG12 ' A' ' 42' ' ' VAL . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 71.33 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 61.14 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 65.45 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 70.45 110.931 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.657 HG22 ' CD2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 1.049 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 72.31 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.061 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 71.2 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 64.22 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 43.42 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.697 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 71.54 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.23 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 HH22 ' A' ' 73' ' ' ARG . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 53.3 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 135' ' ' LEU . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 61.25 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.33 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.594 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' A' ' 91' ' ' PRO . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 71.24 111.125 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.812 0.339 . . . . 53.22 111.114 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 1.01 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.948 HG21 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 41.51 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 53.15 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.783 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 54.22 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 61.53 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 64.15 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 62.33 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.127 HD13 ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.4 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.33 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 71.3 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.768 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.554 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.914 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.593 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.81 0.338 . . . . 63.42 110.931 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 41.2 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.776 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.519 HG23 HG22 ' A' ' 75' ' ' VAL . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 61.41 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.783 ' HG2' HD11 ' A' ' 20' ' ' LEU . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 41.34 110.86 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.89 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 52.45 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 71.15 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.535 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 1.01 HG23 ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 42.43 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.416 HG12 ' CG ' ' A' ' 17' ' ' ASP . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 73.24 111.136 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.662 ' N ' HD12 ' A' ' 20' ' ' LEU . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 63.1 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.776 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 64.53 110.913 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.593 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 4.5 m-80 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.885 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.01 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.476 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.476 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.2 110.796 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 73.23 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.566 HD21 HG21 ' A' ' 75' ' ' VAL . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 74.25 110.892 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 70.52 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PHE . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.566 HG21 HD21 ' A' ' 67' ' ' LEU . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.43 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.626 HG23 ' HE1' ' A' ' 40' ' ' MET . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 74.4 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.486 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 62.23 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.631 ' HB2' HD21 ' A' ' 140' ' ' LEU . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.44 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 63.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 83' ' ' HIS . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.438 ' N ' HG12 ' A' ' 82' ' ' VAL . 16.8 m-70 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 72.34 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 64.14 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.647 ' CG ' HD13 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 71.22 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' CYS . . . . . 0.438 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' PHE . . . . . 0.63 ' CE1' HD12 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 72.33 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 51.34 111.12 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 50.14 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.44 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 61.35 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 65.35 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 63.41 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 65.03 110.811 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.535 ' HE1' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 70.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.89 ' CE2' HG12 ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 43.34 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 70.33 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.0 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.63 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.601 HG22 ' CG ' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.0 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 63.15 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.948 ' CG2' HG21 ' A' ' 16' ' ' VAL . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 1.127 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 61.33 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.469 HD13 ' HB2' ' A' ' 94' ' ' PHE . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.45 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 71.4 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.627 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 61.53 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.515 HG22 ' HB3' ' A' ' 134' ' ' ASP . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 64.45 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 42.01 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 71.3 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ASP . . . . . 0.515 ' HB3' HG22 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' TRP . . . . . 0.54 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.631 HD21 ' HB2' ' A' ' 79' ' ' TYR . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.14 110.92 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 65.52 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.54 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 63.21 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' LEU . . . . . 0.647 HD13 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.3 111.118 179.858 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.511 -0.236 . . . . 73.5 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -98.96 -45.34 6.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.882 0.372 . . . . 52.3 110.843 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.5 p -50.17 114.52 1.12 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 73.1 110.844 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 141.52 167.63 11.26 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.753 -0.737 . . . . 75.34 112.462 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 153.49 47.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 74.4 110.866 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 25.5 p -146.55 173.17 12.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 64.14 110.891 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.34 -91.64 0.12 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.734 -0.746 . . . . 54.51 112.506 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -84.96 159.05 20.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 52.12 110.844 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.58 81.58 1.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 63.42 110.877 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 2.7 m -174.32 138.91 0.58 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 73.04 110.871 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 mt -133.01 -175.16 3.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 71.04 110.928 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.65 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.7 p -96.83 44.82 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 74.42 111.173 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.7 p -38.73 139.37 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.154 -0.475 . . . . 70.5 111.172 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.6 m -115.71 160.55 19.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.42 110.89 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.25 173.7 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.22 110.889 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.927 HG21 ' CG2' ' A' ' 120' ' ' THR . 2.9 p -102.3 96.91 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.112 -0.495 . . . . 72.44 111.124 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.44 140.29 0.33 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.603 0.716 . . . . 64.44 110.901 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.8 -32.0 19.28 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.678 2.252 . . . . 62.11 112.323 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.73 -26.08 62.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 72.22 110.915 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.62 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.8 tt -87.58 -48.41 7.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 65.52 110.94 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.4 ttmt -34.69 -45.76 0.26 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 54.41 110.945 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -65.68 -46.78 77.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.23 110.898 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.447 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.8 m -44.28 -41.13 5.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 74.12 111.115 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.142 HD13 ' HB2' ' A' ' 121' ' ' ALA . 19.6 mt -70.64 -54.74 10.8 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 71.44 110.919 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.595 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 3.7 ttm-85 -52.07 -30.97 28.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 75.23 110.914 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mttt -82.4 -44.55 15.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.466 . . . . 64.42 110.889 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.843 ' CD1' HD11 ' A' ' 38' ' ' ILE . 11.8 t80 -54.7 -42.89 72.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 73.03 110.873 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.585 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.2 mtm-85 -66.0 -26.14 67.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.881 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.595 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -129.43 40.75 3.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.54 110.903 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -73.63 165.63 24.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 72.45 110.854 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.69 33.67 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 63.35 110.888 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.401 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 23.4 mt-10 -113.89 175.25 5.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 74.34 110.839 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 69.4 p -148.19 26.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.158 -0.474 . . . . 73.54 111.102 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 3.7 p-10 -126.13 -176.69 3.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.444 . . . . 65.44 110.904 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -83.63 127.28 33.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.23 110.93 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -137.76 154.98 49.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 52.31 111.09 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -130.2 150.18 51.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 51.52 111.042 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.843 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.8 mt -133.48 110.43 14.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 71.3 111.12 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.472 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -96.57 119.9 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.44 111.136 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.75 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -116.57 145.95 42.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 55.52 110.916 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.92 176.94 5.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 62.42 110.855 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.833 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -124.22 122.62 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 74.03 111.167 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -82.33 120.31 25.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 73.13 110.838 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -68.55 -16.31 63.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 64.45 110.924 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.3 -39.03 33.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 64.24 110.847 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' A' ' 47' ' ' GLN . 7.7 mtp180 -110.88 9.02 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 75.1 110.868 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.5 mm-40 33.98 48.55 0.24 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 54.51 110.849 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.8 ptm -141.75 144.36 33.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 72.24 110.902 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.457 HG11 HD23 ' A' ' 117' ' ' LEU . 10.9 t -76.33 117.5 21.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 73.43 111.109 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.463 ' C ' HD12 ' A' ' 20' ' ' LEU . 33.8 m -125.25 144.49 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 65.34 111.144 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.62 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.6 tp -49.71 144.43 6.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 63.04 110.906 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -116.29 -40.37 3.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.86 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -166.77 163.0 16.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.198 -0.456 . . . . 62.21 110.872 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.809 ' HG3' HG23 ' A' ' 38' ' ' ILE . 3.7 mt-10 -147.83 116.18 6.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.22 110.865 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.452 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.3 mt -114.29 140.15 48.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 62.33 110.921 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 -117.66 163.03 17.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 75.42 110.914 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.44 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 10.4 m-80 46.34 52.82 10.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 55.23 110.85 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.983 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.46 139.72 50.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.229 -0.441 . . . . 74.52 111.071 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.2 169.26 18.99 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.658 0.742 . . . . 72.11 110.822 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.71 -0.43 6.87 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.653 2.235 . . . . 73.52 112.38 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.604 ' O ' HD23 ' A' ' 65' ' ' LEU . 4.6 mt-10 -99.93 -28.77 12.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.44 110.918 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.21 -44.29 26.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.871 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.719 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -49.91 -47.35 52.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 73.03 110.869 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.575 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -56.13 -33.45 65.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.23 -0.441 . . . . 71.41 110.915 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.604 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -74.76 -33.75 62.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 52.22 110.915 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.452 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.7 mm-40 -70.87 -30.58 67.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 51.21 110.886 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.947 HD21 HG21 ' A' ' 75' ' ' VAL . 83.1 mt -69.78 154.9 94.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.621 0.724 . . . . 75.33 110.924 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.472 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -165.41 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.633 2.222 . . . . 75.41 112.351 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.61 -16.26 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 72.52 110.901 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.23 43.6 0.46 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.12 110.857 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.39 115.65 5.85 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.602 0.715 . . . . 75.31 110.909 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.442 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.75 137.49 35.59 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.653 2.235 . . . . 73.22 112.357 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.472 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 13.1 ptp180 -165.96 167.6 16.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.885 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 114' ' ' LYS . 30.0 m-85 -95.93 145.97 24.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 64.1 110.877 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 HD21 ' A' ' 67' ' ' LEU . 39.3 t -146.48 122.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 74.43 111.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.75 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.2 t -110.52 97.86 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.33 111.16 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -92.86 137.91 31.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 61.12 110.947 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.2 t -117.62 97.47 5.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.33 110.864 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.512 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.8 t80 -84.65 165.32 18.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 73.04 110.917 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.512 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 6.2 tttt -119.0 108.56 14.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 71.11 110.886 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.38 133.09 49.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 71.31 110.93 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.605 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.9 p -104.26 162.78 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 64.22 111.162 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG22 ' A' ' 82' ' ' VAL . 18.0 m-70 -104.24 -79.94 0.54 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 74.54 110.887 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 166.38 -52.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.241 -0.436 . . . . 64.3 110.913 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -58.23 -13.52 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 71.23 110.825 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.16 21.16 2.6 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.733 -0.746 . . . . 62.32 112.483 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -117.16 133.79 55.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.812 0.339 . . . . 63.31 110.872 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.605 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.5 p -141.28 121.31 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.126 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 19.8 m -118.03 158.05 25.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 50.01 110.836 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -106.9 95.24 12.07 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.666 0.746 . . . . 61.31 110.894 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.3 Cg_endo -69.8 96.89 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.678 2.252 . . . . 74.33 112.305 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.54 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.28 130.14 40.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.906 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.2 m -128.69 163.4 25.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.187 -0.461 . . . . 72.4 110.921 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 64.8 t80 -106.54 104.85 14.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 74.03 110.901 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 80.7 mt -93.27 108.77 20.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 73.1 111.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.4 t80 -89.2 106.85 18.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.904 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.4 t -78.84 99.83 6.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.885 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 59.6 p -133.99 93.88 19.42 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.623 0.725 . . . . 64.12 110.881 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 176.47 6.73 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.693 2.262 . . . . 71.44 112.318 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.0 p -105.67 8.98 9.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 43.21 111.077 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -113.45 2.43 25.0 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.774 -0.727 . . . . 34.5 112.483 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.4 p -82.59 174.95 10.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.864 0.364 . . . . 52.23 110.911 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.21 147.94 35.64 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.509 0.671 . . . . 72.0 110.901 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -13.47 34.67 Favored 'Trans proline' 0 C--N 1.34 0.128 0 C-N-CA 122.637 2.224 . . . . 61.2 112.364 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.73 -35.51 60.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 65.43 110.837 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -89.92 -56.82 3.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 62.54 110.919 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.42 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.89 -41.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 73.41 110.921 -179.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.5 mtm -62.47 -44.48 96.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 72.43 110.859 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.532 ' HG2' HG11 ' A' ' 12' ' ' VAL . 76.0 mtp -51.26 -37.18 45.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 52.04 110.864 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.833 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.8 m-85 -89.46 -33.41 16.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 72.45 110.953 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.15 -27.7 66.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.086 -0.507 . . . . 74.04 111.095 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.76 -28.44 14.09 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.742 -0.742 . . . . 65.24 112.481 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.2 m -95.45 -10.51 29.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.941 0.4 . . . . 71.22 110.867 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.417 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 23.2 ttpt -49.7 -57.92 6.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.106 -0.497 . . . . 74.33 110.914 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 14.2 m-80 -53.23 -40.49 64.59 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 75.03 110.889 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.9 tpp180 -62.95 -55.22 27.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 73.13 110.865 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.653 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -58.15 -46.37 85.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.916 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 94' ' ' PHE . 67.0 t -61.89 -53.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.13 111.115 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -52.37 -30.83 30.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.11 110.89 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.927 ' CG2' HG21 ' A' ' 16' ' ' VAL . 5.2 m -69.14 -43.95 73.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 74.33 111.116 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.142 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -75.59 -12.96 60.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.066 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 62.99 52.42 2.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 60.13 110.886 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.505 HD13 ' HB2' ' A' ' 94' ' ' PHE . 28.5 mt -100.43 111.56 23.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.33 110.915 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 2.1 t -74.6 -14.51 60.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 72.11 111.148 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 8.9 mtmm -113.71 116.77 29.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.239 -0.437 . . . . 64.21 110.889 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 14.9 t -131.58 126.11 57.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 71.13 111.146 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.583 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.3 m-85 -124.2 155.41 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 75.34 110.868 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -123.07 117.99 26.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.883 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.576 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 3.7 pt -95.86 120.05 44.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 75.31 111.164 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.2 -8.46 31.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.888 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 t 179.68 148.61 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.48 . . . . 63.25 111.161 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 39.3 p -45.8 -48.49 15.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 75.4 111.104 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -41.46 -40.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 62.35 110.843 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.584 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.6 OUTLIER -56.27 -41.86 76.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.872 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.719 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -61.36 84.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 35.21 110.954 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 p -126.23 148.82 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.203 -0.453 . . . . 71.34 111.12 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.9 tt0 -39.48 -39.65 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 53.34 110.884 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.417 HG22 ' HG3' ' A' ' 142' ' ' GLU . 9.1 m -76.17 -64.93 0.99 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 71.21 111.127 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.584 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 2.0 t90 -42.82 -24.39 0.06 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 75.52 110.887 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.73 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.5 OUTLIER -84.28 -59.38 2.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.04 110.97 179.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.73 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.4 OUTLIER -59.51 -20.77 57.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 50.1 110.887 179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.417 ' HG3' HG22 ' A' ' 138' ' ' THR . 21.7 mt-10 -69.56 -45.51 68.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 64.41 110.922 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.583 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.3 mmtt -65.21 -35.57 81.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 74.03 110.919 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 18.0 mt -72.62 -53.26 12.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 65.0 110.91 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -37.95 -72.52 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 74.3 111.113 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.43 76.08 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.234 -0.439 . . . . 72.42 110.858 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 61.42 145.72 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 51.33 112.47 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -168.69 0.29 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.67 2.247 . . . . 61.05 112.348 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -102.37 112.75 25.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 72.51 110.858 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 18.3 m 57.7 166.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.066 -0.516 . . . . 71.23 110.883 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 41.34 112.486 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 112.507 -0.237 . . . . 65.54 112.507 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -121.1 -50.3 2.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 73.44 110.842 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.8 t -174.91 -56.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 75.43 110.877 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.25 -144.74 39.8 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.705 -0.759 . . . . 71.41 112.476 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 6' ' ' SER . 0.3 OUTLIER -134.1 -64.05 0.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.867 0.365 . . . . 74.11 110.826 -179.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.1 OUTLIER 79.21 -55.9 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 72.12 110.88 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.22 -84.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 61.03 112.568 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -126.8 131.5 51.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 72.22 110.834 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.56 86.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.495 . . . . 72.43 110.889 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 61.3 m -88.02 129.8 35.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.836 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.1 mt -137.4 179.1 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 73.44 110.815 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 12' ' ' VAL . 11.0 p -105.27 44.65 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.14 -0.482 . . . . 71.5 111.123 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.422 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.5 p -37.88 153.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.22 -0.445 . . . . 71.31 111.106 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' N ' HG22 ' A' ' 13' ' ' VAL . 71.0 m -129.79 160.54 33.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 70.1 110.84 180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.31 174.01 9.34 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 44.52 110.877 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.885 HG21 HG21 ' A' ' 120' ' ' THR . 12.1 p -104.74 96.7 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 63.2 111.095 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 13.5 t70 -33.26 139.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.624 0.726 . . . . 65.43 110.871 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.75 -30.38 22.4 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.693 2.262 . . . . 70.42 112.314 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.79 -25.56 62.06 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 71.11 110.905 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.597 HD11 ' HG2' ' A' ' 40' ' ' MET . 0.9 OUTLIER -88.63 -47.62 8.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 73.3 110.978 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.434 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.5 ttmt -34.9 -49.02 0.43 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.484 . . . . 71.35 110.92 179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.1 mt-10 -62.59 -48.71 78.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.89 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.8 m -45.52 -43.1 11.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.176 -0.466 . . . . 75.21 111.173 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 30.3 mt -66.19 -52.99 42.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 63.53 110.981 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -57.25 -30.52 64.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 55.23 110.873 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -80.4 -42.22 23.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 71.32 110.879 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.773 ' CD2' HD21 ' A' ' 92' ' ' LEU . 8.7 t80 -54.72 -42.05 71.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.221 -0.445 . . . . 33.21 110.876 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.5 mtm-85 -67.68 -29.67 69.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.184 -0.462 . . . . 70.51 110.881 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -123.4 39.69 3.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.16 -0.473 . . . . 73.01 110.867 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -72.81 162.64 29.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 74.23 110.855 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -90.99 20.64 4.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 73.4 110.866 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 3.2 mp0 -100.51 179.34 4.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 60.41 110.9 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.8 p -151.57 26.54 0.66 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 73.43 111.155 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -127.02 -178.17 4.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 71.14 110.848 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -82.99 129.43 35.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 74.43 110.859 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.48 156.85 46.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.15 -0.477 . . . . 63.1 111.089 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -132.69 149.25 52.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.247 -0.433 . . . . 64.14 111.187 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.5 mt -135.05 110.04 11.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.282 -0.417 . . . . 72.25 111.113 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' NH1' ' A' ' 73' ' ' ARG . 4.2 mt -96.03 113.75 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 64.11 111.189 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.81 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.3 OUTLIER -105.29 143.18 33.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.53 110.861 179.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -117.18 171.54 7.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 75.14 110.927 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.759 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -127.07 111.57 26.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.252 -0.431 . . . . 64.43 111.1 179.81 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 54.1 m-20 -75.02 118.29 17.82 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 72.51 110.879 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -62.16 -27.86 69.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 62.42 110.971 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -69.3 -45.24 70.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.849 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 47' ' ' GLN . 56.7 mtp180 -98.42 3.73 48.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.244 -0.435 . . . . 41.11 110.857 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.1 mm-40 37.67 43.57 0.47 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.921 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 ptm -138.88 156.19 47.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 71.35 110.92 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.7 t -89.25 113.65 26.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 73.43 111.145 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.2 m -120.05 146.24 25.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 73.12 111.16 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 54' ' ' GLU . 2.2 tp -51.68 146.94 7.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.1 110.914 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -122.22 -41.88 2.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 63.41 110.913 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -158.43 162.08 37.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.171 -0.468 . . . . 62.41 110.847 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.729 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.3 mt-10 -151.47 107.56 3.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 70.11 110.902 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.456 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -109.26 136.53 48.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.92 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -112.13 163.18 14.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 64.15 110.909 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 44.14 57.24 4.34 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.908 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.965 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.31 140.57 48.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.134 -0.484 . . . . 63.35 111.061 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -82.4 169.55 17.83 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 121.71 0.767 . . . . 53.53 110.856 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.77 -0.79 7.43 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.661 2.24 . . . . 75.31 112.339 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.606 ' O ' HD23 ' A' ' 65' ' ' LEU . 21.6 mt-10 -98.55 -31.56 11.9 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.236 -0.438 . . . . 64.42 110.886 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -46.87 26.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 75.54 110.894 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.685 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -46.29 -47.17 18.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.886 -179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -58.84 -35.9 73.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 65.22 110.891 179.861 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.1 mm? -71.65 -20.09 62.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.218 -0.446 . . . . 72.3 110.95 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.456 ' HG3' HD13 ' A' ' 55' ' ' LEU . 10.2 mm-40 -86.7 -24.11 25.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 71.33 110.917 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 84.7 mt -76.8 154.67 83.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.624 0.725 . . . . 73.12 110.901 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.424 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.72 -169.1 0.31 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.684 2.256 . . . . 43.12 112.328 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' NE ' ' A' ' 70' ' ' ARG . 1.4 pt-20 -111.13 -28.16 8.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 63.41 110.913 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.49 ' NE ' ' O ' ' A' ' 69' ' ' GLU . 5.5 mmt180 -149.18 50.39 0.97 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.116 -0.493 . . . . 74.02 110.848 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.424 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -139.78 116.2 8.21 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.582 0.706 . . . . 75.02 110.946 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.572 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.4 Cg_endo -69.72 137.87 36.61 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.674 2.249 . . . . 74.33 112.343 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.612 ' NH1' HG21 ' A' ' 39' ' ' ILE . 0.0 OUTLIER -170.27 163.06 8.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.24 110.915 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -96.26 148.36 22.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 65.12 110.907 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 22.9 t -149.35 124.55 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 71.44 111.096 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.81 HG23 ' HE1' ' A' ' 40' ' ' MET . 24.5 t -107.26 101.61 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.103 -0.499 . . . . 74.41 111.146 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -96.35 137.11 35.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 72.3 110.91 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.2 t -116.13 96.49 5.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.43 110.788 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.556 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 42.5 t80 -83.61 167.14 17.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 73.05 110.987 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 1.7 tttt -121.92 111.54 17.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 71.01 110.836 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.507 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.3 OUTLIER -106.07 136.95 44.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.244 -0.435 . . . . 74.35 110.924 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.751 HG23 ' HB ' ' A' ' 88' ' ' VAL . 4.1 p -105.94 164.32 4.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 53.53 111.152 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.436 ' H ' HG22 ' A' ' 82' ' ' VAL . 17.1 m-70 -103.24 -86.62 0.44 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.86 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.19 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.449 . . . . 61.34 110.885 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.18 -3.31 32.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 74.12 110.879 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 114.83 17.22 7.0 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.771 -0.728 . . . . 74.04 112.463 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -112.11 134.34 53.72 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.803 0.335 . . . . 75.14 110.876 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.751 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -142.62 125.43 13.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.213 -0.449 . . . . 74.21 111.113 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.2 m -121.0 158.22 28.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.138 -0.483 . . . . 64.0 110.889 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 4.7 m-85 -105.75 95.02 9.7 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.664 0.745 . . . . 72.43 110.882 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.468 ' HB2' HD22 ' A' ' 144' ' ' LEU . 54.2 Cg_endo -69.73 95.83 0.57 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.688 2.259 . . . . 74.12 112.363 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.773 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.21 128.24 35.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.245 -0.434 . . . . 75.11 110.909 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.5 m -127.71 168.04 15.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 65.22 110.882 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.414 ' CE2' ' CG2' ' A' ' 118' ' ' VAL . 71.9 t80 -111.96 104.86 13.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.256 -0.429 . . . . 74.13 110.899 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 72.5 mt -93.53 109.71 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 61.32 111.175 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -94.42 110.49 22.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 72.22 110.939 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.9 t -80.09 93.99 5.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 70.21 110.836 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.404 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 46.9 p -124.53 94.11 45.25 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.66 0.743 . . . . 71.54 110.808 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.8 Cg_endo -69.77 -163.45 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.659 2.239 . . . . 73.53 112.314 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.32 -30.83 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 52.45 111.144 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.2 9.32 33.83 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.716 -0.754 . . . . 72.4 112.501 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -84.38 -178.07 6.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.926 0.393 . . . . 64.42 110.89 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.5 147.68 34.37 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.517 0.675 . . . . 71.1 110.875 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -14.79 36.64 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.68 2.254 . . . . 73.04 112.332 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -74.08 -38.19 63.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.836 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.5 mm100 -87.92 -59.0 2.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.852 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.0 -40.43 0.29 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.881 -179.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.0 mtm -62.75 -43.04 99.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.243 -0.435 . . . . 74.14 110.949 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.9 mtp -53.64 -33.41 55.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 74.03 110.9 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.759 ' CE2' HG12 ' A' ' 42' ' ' VAL . 35.1 m-85 -92.59 -33.55 14.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.469 . . . . 74.43 110.917 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.93 -24.42 64.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.089 -0.505 . . . . 45.04 111.146 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.79 -21.93 24.81 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.747 -0.74 . . . . 64.22 112.484 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.3 m -101.57 -17.11 16.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.931 0.396 . . . . 45.24 110.877 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.628 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.8 ttpt -41.97 -57.37 2.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 63.53 110.893 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -57.34 -38.96 74.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 64.1 110.882 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.1 tpp180 -62.19 -57.3 12.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 63.1 110.841 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.724 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.8 tm? -59.11 -47.56 84.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.47 . . . . 70.32 110.91 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 114' ' ' LYS . 88.7 t -59.79 -51.2 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 63.11 111.122 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -38.92 62.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 72.55 110.909 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.885 HG21 HG21 ' A' ' 16' ' ' VAL . 5.8 m -62.32 -43.43 98.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 61.44 111.143 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.7 -26.01 61.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 72.44 111.147 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 74.66 41.95 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 63.04 110.961 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 8.3 mt -96.24 93.4 6.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 53.3 m -49.95 -49.19 51.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 64.2 111.135 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 mtmm -76.22 123.44 25.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 73.41 110.931 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.402 HG13 ' HD2' ' A' ' 94' ' ' PHE . 19.9 t -133.84 119.5 32.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 75.45 111.103 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 15.3 m-85 -116.68 152.43 34.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.917 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.87 128.7 48.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 74.13 110.899 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.526 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 3.9 pt -107.83 133.31 53.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 71.33 111.158 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 3.0 tpp85 -85.89 1.26 50.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.883 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 179.74 144.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 63.33 111.142 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 40.9 p -50.64 -36.53 35.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 62.43 111.079 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.18 -35.82 50.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 75.22 110.905 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.452 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -59.48 -40.62 87.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 73.12 110.787 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.685 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.4 tp -60.26 82.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.23 110.927 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.414 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -124.77 150.42 46.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 62.51 111.165 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 2.9 tt0 -43.45 -41.95 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 74.43 110.845 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.406 HG22 ' HG3' ' A' ' 142' ' ' GLU . 24.6 m -72.85 -54.74 8.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.112 -0.495 . . . . 74.32 111.122 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.526 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 2.1 t90 -53.32 -22.39 7.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.198 -0.455 . . . . 71.44 110.948 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.89 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.2 OUTLIER -87.82 -55.95 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 74.21 110.983 179.95 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.89 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -60.92 -26.15 67.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.15 110.917 179.801 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.406 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.0 mt-10 -65.14 -44.08 89.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.866 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.579 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.9 mmtt -65.56 -37.43 86.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 73.51 110.897 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.468 HD22 ' HB2' ' A' ' 91' ' ' PRO . 17.1 mt -71.44 -45.89 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.899 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -52.13 178.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 72.51 111.089 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 56.8 p -100.42 43.36 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.449 . . . . 52.45 110.812 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 66.99 151.72 0.19 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.713 -0.756 . . . . 71.21 112.495 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 -174.85 0.97 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 74.54 112.386 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.22 125.7 37.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 64.01 110.906 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 12.5 t -85.85 122.12 29.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.827 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.666 -0.778 . . . . 63.35 112.464 179.988 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.469 -0.252 . . . . 74.41 112.469 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 t -152.57 121.35 6.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.873 0.368 . . . . 70.52 110.878 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 66.41 123.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.114 -0.494 . . . . 73.51 110.906 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.433 ' O ' ' C ' ' A' ' 5' ' ' SER . . . 126.56 -46.26 1.1 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.706 -0.759 . . . . 63.23 112.434 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' GLY . 0.1 OUTLIER -35.83 121.0 0.63 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.848 0.356 . . . . 65.04 110.859 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 p -147.82 -52.72 0.2 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.862 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -101.0 -37.8 3.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.727 -0.749 . . . . 51.25 112.521 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.7 83.93 0.16 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.93 0.395 . . . . 72.21 110.896 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -173.09 76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 55.21 110.817 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.0 p 51.9 174.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.446 . . . . 43.14 110.871 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mt -143.97 -173.82 4.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 40.41 110.892 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 12' ' ' VAL . 9.2 p -103.5 44.52 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 53.42 111.112 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -40.92 140.66 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 65.14 111.161 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.6 m -118.12 -178.1 3.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.144 -0.48 . . . . 73.22 110.83 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -109.33 163.78 13.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 74.13 110.884 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 16' ' ' VAL . 12.9 p -91.09 97.85 7.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 63.11 111.106 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.499 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.3 t70 -33.16 140.47 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.643 0.735 . . . . 71.25 110.821 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.85 -30.99 21.0 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.706 2.271 . . . . 54.13 112.347 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -74.03 -26.18 60.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 62.12 110.846 -179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.493 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -89.3 -40.66 12.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 75.44 110.927 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 12.7 ttmt -38.94 -47.72 1.48 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.11 110.921 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.4 mt-10 -66.04 -46.7 76.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.45 . . . . 72.44 110.889 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.473 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.4 m -44.86 -45.83 10.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.093 -0.503 . . . . 72.22 111.199 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.9 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.6 mt -67.58 -48.99 65.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.191 -0.459 . . . . 55.14 110.893 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -59.8 -28.87 67.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.881 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 30' ' ' ARG . 7.3 mttt -84.55 -37.69 20.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.481 . . . . 75.51 110.912 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.781 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -59.98 -36.65 77.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 63.52 110.81 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.418 ' NH1' ' O ' ' A' ' 122' ' ' GLU . 6.6 mtm180 -70.47 -35.43 73.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 73.32 110.843 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -123.27 40.08 3.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.861 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -70.04 162.69 27.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 71.4 110.905 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -85.84 30.3 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 55.13 110.871 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 22.2 mm-40 -114.39 177.11 4.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.231 -0.44 . . . . 74.2 110.875 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.9 p -149.73 30.43 0.73 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 62.24 111.184 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.522 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -129.64 175.31 8.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 65.33 110.917 179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.522 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 24.5 m-20 -77.33 141.32 39.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 63.44 110.876 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -158.69 155.92 28.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 73.21 111.156 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.874 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -132.07 154.07 49.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 74.43 111.103 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.543 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.3 mt -133.72 106.16 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 73.31 111.14 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.685 HG21 ' CZ ' ' A' ' 73' ' ' ARG . 6.4 mt -88.36 116.26 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.099 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.674 ' CE ' HG23 ' A' ' 76' ' ' VAL . 3.0 mtm -115.73 154.16 30.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.842 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -132.63 176.72 8.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.33 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.776 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -120.14 118.7 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.091 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.404 ' O ' ' N ' ' A' ' 47' ' ' GLN . 6.2 m-20 -78.46 115.48 18.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 65.51 110.918 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -67.26 -13.24 61.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.905 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.88 -28.52 29.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 71.52 110.836 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -120.96 3.76 10.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 73.3 110.845 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.404 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.3 mm-40 41.2 50.71 3.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 64.44 110.913 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -146.21 148.91 33.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.253 -0.43 . . . . 74.44 110.922 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.881 HG11 HD13 ' A' ' 117' ' ' LEU . 44.0 t -82.75 113.28 21.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.302 -0.408 . . . . 71.43 111.106 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.3 m -121.86 141.32 42.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.41 111.148 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.816 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.0 OUTLIER -49.36 147.31 3.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 65.32 110.955 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 6.5 tt0 -120.08 -51.6 2.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.55 110.931 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -149.92 166.26 30.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.15 110.86 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.816 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.9 mt-10 -151.56 117.22 5.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 72.42 110.902 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.3 mt -116.49 130.98 57.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.104 -0.498 . . . . 72.43 110.928 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 18.8 mp0 -113.62 159.59 19.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 74.25 110.896 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.504 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 57.79 45.08 19.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.918 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.937 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -125.3 142.89 40.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.125 -0.489 . . . . 74.35 111.052 179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.499 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -86.13 169.81 14.43 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.675 0.75 . . . . 61.42 110.813 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.894 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.5 Cg_endo -69.78 3.86 2.54 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.602 2.201 . . . . 72.4 112.372 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' O ' HD23 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -108.58 -18.52 13.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.436 . . . . 73.34 110.872 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.3 -38.53 15.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 65.14 110.862 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.874 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.7 OUTLIER -57.38 -57.76 11.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 62.45 110.978 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.73 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -37.69 -38.92 0.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.159 -0.473 . . . . 74.13 110.83 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.73 HD22 ' HG2' ' A' ' 64' ' ' LYS . 2.4 mm? -68.06 -42.33 80.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.295 -0.411 . . . . 75.34 110.969 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' N ' ' O ' ' A' ' 63' ' ' LEU . 16.9 mm-40 -60.9 -25.95 67.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.915 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.872 HD21 HG21 ' A' ' 75' ' ' VAL . 71.0 mt -74.94 148.85 85.0 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.629 0.728 . . . . 44.53 110.884 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.69 -164.19 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.71 2.273 . . . . 74.02 112.358 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -121.21 -30.19 4.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.01 110.894 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.451 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 10.4 mmt-85 -138.32 32.94 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.867 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.38 107.53 14.65 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.546 0.689 . . . . 52.1 110.931 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.56 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.2 Cg_endo -69.79 123.97 10.61 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.675 2.25 . . . . 31.21 112.319 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.685 ' CZ ' HG21 ' A' ' 39' ' ' ILE . 2.0 ptm180 -147.63 173.26 12.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.85 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -106.22 147.83 28.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 73.42 110.844 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.872 HG21 HD21 ' A' ' 67' ' ' LEU . 97.7 t -151.27 126.27 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.098 -0.501 . . . . 73.45 111.11 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.674 HG23 ' CE ' ' A' ' 40' ' ' MET . 49.9 t -108.82 97.06 5.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 75.11 111.172 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.45 ' HD1' ' HB2' ' A' ' 37' ' ' ALA . 9.6 t80 -90.2 135.89 33.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.891 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 17.0 t -115.15 98.29 6.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 53.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.588 ' CE1' ' O ' ' A' ' 80' ' ' LYS . 56.4 t80 -86.29 163.61 17.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.222 -0.444 . . . . 71.11 110.917 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.588 ' O ' ' CE1' ' A' ' 79' ' ' TYR . 3.4 ttpm? -115.7 113.22 23.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 63.43 110.918 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -108.49 133.24 52.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.221 -0.445 . . . . 74.3 110.944 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 12.4 t -99.13 145.73 9.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.064 -0.516 . . . . 72.32 111.154 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 20.8 m-70 -83.22 -93.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.828 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 178.36 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.31 110.906 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.24 -10.84 59.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 64.14 110.838 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.38 11.5 5.08 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.808 -0.71 . . . . 51.4 112.506 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -109.98 131.65 54.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.919 0.39 . . . . 60.53 110.849 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 88' ' ' VAL . 6.8 p -132.61 119.88 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.163 -0.471 . . . . 55.1 111.092 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 15.8 m -114.44 161.76 17.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 72.01 110.812 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.416 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.6 OUTLIER -111.99 95.25 28.53 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.625 0.726 . . . . 72.55 110.919 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.6 Cg_endo -69.81 97.34 0.64 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.718 2.279 . . . . 73.12 112.297 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.781 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.1 124.23 24.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.897 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.514 ' SG ' HD21 ' A' ' 144' ' ' LEU . 99.5 m -120.53 163.8 17.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.453 . . . . 74.44 110.851 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.755 ' CD1' HG22 ' A' ' 118' ' ' VAL . 50.9 t80 -108.38 105.34 14.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.55 110.898 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 77' ' ' TYR . 78.0 mt -93.53 116.49 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 74.15 111.094 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -97.64 107.21 19.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 63.55 110.872 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.2 t -78.78 92.09 4.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 74.33 110.894 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 0.3 OUTLIER -128.65 96.31 30.28 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.682 0.753 . . . . 53.13 110.892 -179.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.6 Cg_endo -69.8 -167.24 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.68 2.253 . . . . 55.04 112.312 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.4 p -110.2 -22.97 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 72.34 111.167 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.451 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -81.97 -16.06 73.39 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.727 -0.749 . . . . 72.1 112.436 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.2 p -55.27 178.2 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.872 0.368 . . . . 74.35 110.899 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.9 149.43 37.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.611 0.719 . . . . 75.53 110.906 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.68 -21.46 33.82 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.664 2.243 . . . . 70.52 112.324 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.14 -39.23 82.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.214 -0.448 . . . . 64.44 110.872 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.494 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.6 mm100 -88.66 -58.48 2.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.16 -0.473 . . . . 65.12 110.943 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.52 -40.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 70.0 110.965 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 3.8 mtm -63.17 -44.03 96.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 61.12 110.894 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.494 ' N ' ' O ' ' A' ' 106' ' ' GLN . 51.2 mtp -53.76 -33.04 54.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 75.33 110.905 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.776 ' CE2' HG12 ' A' ' 42' ' ' VAL . 38.3 m-85 -92.15 -33.08 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.281 -0.418 . . . . 71.22 110.991 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.85 -20.07 62.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.07 -0.514 . . . . 61.12 111.065 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.98 -13.29 34.4 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 72.4 112.473 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.1 m -114.31 -11.05 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.917 0.389 . . . . 70.11 110.912 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 118' ' ' VAL . 36.4 ttpt -48.93 -54.34 15.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.03 110.847 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -61.23 -38.37 86.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.295 -0.411 . . . . 55.43 110.918 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 4.9 tpp180 -56.23 -52.07 65.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 73.32 110.857 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.881 HD13 HG11 ' A' ' 49' ' ' VAL . 6.7 tp -67.34 -57.26 6.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.933 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.755 HG22 ' CD1' ' A' ' 94' ' ' PHE . 87.3 t -47.61 -51.26 7.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.238 -0.437 . . . . 64.31 111.09 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -52.72 -39.92 62.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.882 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.71 HG21 HG21 ' A' ' 16' ' ' VAL . 5.9 m -61.94 -43.77 98.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 73.2 111.17 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.9 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.09 -18.33 61.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 52.15 111.075 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.418 ' O ' ' NH1' ' A' ' 28' ' ' ARG . 1.4 tt0 64.41 26.94 13.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.888 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 94' ' ' PHE . 17.0 mt -65.0 -34.67 78.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.886 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.6 m 73.15 -63.85 0.42 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.162 -0.472 . . . . 62.02 111.147 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -72.62 122.43 21.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 71.0 110.926 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.567 ' CG2' HG11 ' A' ' 118' ' ' VAL . 16.5 t -128.19 124.51 62.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 74.43 111.157 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.464 ' HE2' ' HG ' ' A' ' 93' ' ' CYS . 19.3 m-85 -121.7 116.73 25.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.36 124.59 40.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 74.51 110.878 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.401 HG22 ' HB3' ' A' ' 134' ' ' ASP . 14.6 pt -100.48 127.75 53.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 63.52 111.067 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -72.46 -14.66 61.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.878 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.456 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.4 t -168.64 134.76 1.81 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.454 . . . . 75.12 111.093 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.5 HG22 ' HB2' ' A' ' 67' ' ' LEU . 78.1 p -33.63 -46.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.152 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -39.67 -49.36 2.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 74.14 110.904 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -40.09 -46.3 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 74.2 110.867 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.894 HD22 ' O ' ' A' ' 60' ' ' PRO . 0.3 OUTLIER -52.49 87.73 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.462 . . . . 73.22 110.941 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 138' ' ' THR . 0.7 OUTLIER -133.11 132.35 41.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.136 179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.444 ' C ' ' O ' ' A' ' 136' ' ' THR . 28.7 tt0 -34.55 -32.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 136' ' ' THR . 7.2 m -79.6 -63.99 1.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.42 111.135 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 9.5 t90 -44.61 -26.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.148 -0.478 . . . . 75.22 110.933 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 6.9 tp -85.18 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 50.5 110.914 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -54.73 -18.24 4.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 70.41 110.869 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -71.17 -50.36 34.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.237 -0.438 . . . . 64.02 110.875 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.17 -37.78 88.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.109 -0.496 . . . . 61.22 110.873 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.514 HD21 ' SG ' ' A' ' 93' ' ' CYS . 11.7 mt -72.49 -43.3 63.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.227 -0.442 . . . . 74.24 110.911 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.58 -69.24 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.445 . . . . 62.43 111.099 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 7.9 t -170.89 32.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 61.32 110.852 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.41 163.56 17.75 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.743 -0.741 . . . . 61.24 112.485 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 179.19 3.88 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.655 2.237 . . . . 54.24 112.363 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 30.4 t -67.45 -61.48 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.453 . . . . 75.04 110.819 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 76.2 p -147.18 172.79 13.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 73.51 110.837 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.768 -0.729 . . . . 53.33 112.51 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.536 -0.226 . . . . 54.04 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -164.64 116.55 1.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.353 . . . . 55.24 110.972 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.12 90.93 8.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.49 . . . . 64.41 110.814 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.54 166.57 12.6 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.742 -0.742 . . . . 72.13 112.451 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 p -178.59 -44.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.833 0.349 . . . . 73.2 110.848 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 40.3 t -76.85 -53.59 7.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 75.31 110.855 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 143.95 -155.51 26.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.767 -0.73 . . . . 50.51 112.476 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.02 -41.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 70.35 110.845 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -128.59 -141.47 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.09 -0.505 . . . . 74.2 110.839 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.8 p -108.81 151.73 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 64.23 110.891 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD13 ' CA ' ' A' ' 112' ' ' GLY . 3.0 mt -143.88 -172.99 3.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.183 -0.462 . . . . 63.24 110.946 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -94.57 43.02 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 73.33 111.156 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 13' ' ' VAL . 9.8 p -36.02 125.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 73.23 111.179 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.7 m -119.39 -175.31 2.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.904 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -110.03 165.86 11.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 75.53 110.914 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 10.5 p -94.37 101.53 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 55.13 111.142 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.502 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -35.35 140.01 0.34 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.621 0.724 . . . . 50.41 110.867 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.5 Cg_endo -69.73 -30.07 23.0 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.71 2.273 . . . . 60.43 112.299 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.56 -26.31 57.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 65.42 110.849 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.559 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.7 tt -87.41 -35.4 18.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 74.23 110.924 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.457 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.9 ttmt -48.27 -45.91 35.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 73.11 110.876 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.8 mt-10 -65.61 -43.06 90.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 72.44 110.9 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.5 m -48.32 -48.29 36.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 72.15 111.175 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.067 HD13 ' HB2' ' A' ' 121' ' ' ALA . 9.3 mt -63.96 -49.7 71.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.911 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -54.99 -30.01 58.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 64.0 110.826 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.8 OUTLIER -84.39 -36.71 22.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.908 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.822 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -59.08 -35.71 73.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 53.23 110.87 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.4 mtm180 -71.88 -36.32 70.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 71.54 110.891 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -121.62 39.57 3.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.146 -0.479 . . . . 71.0 110.868 -179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -71.61 165.04 24.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 73.25 110.895 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.87 35.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 51.22 110.903 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 14.9 mt-10 -115.35 171.86 7.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 72.32 110.877 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.5 p -145.22 19.19 1.57 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.202 -0.454 . . . . 44.42 111.145 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -119.19 -179.1 3.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 64.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -85.21 130.56 34.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 64.13 110.879 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.99 25.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.475 . . . . 53.25 111.037 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -140.95 152.87 45.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 71.14 111.039 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 ' CG ' ' A' ' 54' ' ' GLU . 10.1 mt -134.49 108.79 11.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 74.23 111.058 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.576 ' CG1' HG22 ' A' ' 75' ' ' VAL . 3.4 mt -95.06 112.06 26.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 63.41 111.101 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.835 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -109.7 149.53 29.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 71.44 110.864 179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -127.19 173.63 9.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.859 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.76 117.51 51.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 71.03 111.108 179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.449 ' O ' ' N ' ' A' ' 47' ' ' GLN . 7.4 m-20 -77.35 118.45 19.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.256 -0.429 . . . . 74.33 110.843 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -66.75 -20.6 65.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 62.42 110.89 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.36 -33.62 55.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.257 -0.429 . . . . 73.33 110.852 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -110.93 -1.4 16.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 72.54 110.848 -179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 43' ' ' ASP . 4.0 mm-40 42.74 54.33 4.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 50.45 110.928 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -151.04 148.88 28.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.808 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 22.1 t -81.51 110.51 16.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.232 -0.44 . . . . 74.35 111.128 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -119.61 139.49 46.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.35 111.129 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.789 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.4 tp -47.16 142.51 3.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.155 -0.475 . . . . 64.53 110.888 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -115.73 -45.06 2.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 72.23 110.891 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -155.42 161.78 40.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 61.12 110.875 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.789 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.1 mt-10 -150.19 111.63 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 72.15 110.896 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.49 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.1 mt -114.0 134.26 54.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.459 . . . . 73.33 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.456 ' O ' HG22 ' A' ' 58' ' ' ILE . 5.2 mp0 -109.38 167.09 10.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 72.32 110.923 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 40.74 57.38 2.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 62.54 110.855 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.955 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.09 139.59 51.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 72.43 111.16 179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.491 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.68 169.65 16.59 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.661 0.743 . . . . 65.53 110.825 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.79 2.2 3.76 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.668 2.245 . . . . 52.03 112.334 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -101.66 -25.55 13.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 72.04 110.888 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.405 ' OE2' HD12 ' A' ' 65' ' ' LEU . 8.2 mm-40 -84.46 -42.15 15.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.211 -0.449 . . . . 73.52 110.858 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.632 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -52.77 -47.09 67.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.141 -0.481 . . . . 71.2 110.875 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -39.82 73.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.432 . . . . 55.43 110.955 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.405 HD12 ' OE2' ' A' ' 62' ' ' GLU . 49.7 mt -68.5 -38.62 81.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 65.55 110.885 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.49 ' HG3' HD13 ' A' ' 55' ' ' LEU . 5.8 mm-40 -67.32 -28.28 67.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.446 . . . . 52.01 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.88 HD21 HG21 ' A' ' 75' ' ' VAL . 38.1 mt -67.91 154.82 93.05 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-O 121.645 0.736 . . . . 62.02 110.888 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -164.75 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.703 2.269 . . . . 54.24 112.389 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.408 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 4.1 pt-20 -125.31 -27.19 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 73.21 110.885 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' HG2' ' C ' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -143.91 35.09 1.25 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 63.3 110.877 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -134.49 109.97 11.34 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.608 0.718 . . . . 72.22 110.965 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.57 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.82 134.54 28.11 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.673 2.249 . . . . 62.43 112.362 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -161.03 171.5 18.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.899 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -98.65 151.11 21.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.463 . . . . 72.14 110.882 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.88 HG21 HD21 ' A' ' 67' ' ' LEU . 24.6 t -151.82 125.37 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 63.25 111.103 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.835 HG23 ' HE1' ' A' ' 40' ' ' MET . 98.5 t -109.92 96.29 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 72.33 111.043 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -90.44 134.3 34.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.881 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -113.16 96.67 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 62.14 110.814 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.498 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 79.5 t80 -83.45 168.18 16.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.061 -0.518 . . . . 73.02 110.935 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.524 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 2.1 ttpm? -121.6 105.93 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 74.45 110.865 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.428 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -101.88 135.28 43.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.936 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.477 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.8 t -97.89 160.13 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 71.44 111.133 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.477 ' N ' HG12 ' A' ' 82' ' ' VAL . 28.8 m-70 -97.88 -95.23 0.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 63.2 110.858 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -178.47 -44.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.906 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -10.55 58.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 73.34 110.895 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.51 17.05 4.03 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.791 -0.719 . . . . 72.11 112.543 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -113.43 142.61 45.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.88 0.371 . . . . 72.12 110.904 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 81' ' ' TYR . 7.1 p -141.81 126.87 17.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.173 -0.467 . . . . 72.25 111.146 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 29.4 m -119.83 161.98 19.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.182 -0.463 . . . . 75.44 110.824 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.524 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -110.0 95.15 19.78 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.671 0.748 . . . . 74.13 110.889 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 54.3 Cg_endo -69.7 96.63 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.721 2.281 . . . . 74.42 112.316 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.822 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.58 124.76 25.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.266 -0.425 . . . . 74.23 110.904 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.471 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 97.4 m -123.0 165.51 16.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.85 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.608 ' HD2' HG13 ' A' ' 126' ' ' VAL . 73.2 t80 -109.28 104.76 13.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 72.03 110.906 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 98.7 mt -93.67 117.45 37.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 62.34 111.121 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -98.14 107.73 20.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 74.14 110.885 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.441 ' HA ' HD11 ' A' ' 129' ' ' ILE . 20.7 t -79.57 92.02 5.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.203 -0.453 . . . . 53.21 110.858 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 52.3 p -128.23 95.82 32.64 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.67 0.748 . . . . 51.1 110.862 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.5 Cg_endo -69.74 -169.4 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 55.13 112.292 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.42 -23.51 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 71.12 111.064 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.37 -7.16 87.99 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.712 -0.756 . . . . 65.34 112.475 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 p -60.86 174.21 0.65 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.896 0.379 . . . . 73.11 110.911 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.54 149.73 36.98 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.565 0.698 . . . . 72.21 110.914 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.66 -17.59 37.95 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.732 2.288 . . . . 75.24 112.368 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -74.85 -35.55 62.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.914 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.3 mm100 -89.92 -58.36 2.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 70.51 110.883 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.18 -41.93 0.17 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.195 -0.457 . . . . 75.42 110.859 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.5 mtm -63.69 -46.02 87.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.274 -0.421 . . . . 72.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.495 ' N ' ' O ' ' A' ' 106' ' ' GLN . 73.7 mtp -48.6 -34.74 12.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 70.03 110.885 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.3 m-85 -92.74 -36.16 13.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.446 . . . . 73.35 110.948 -179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.24 -31.0 69.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 64.34 111.095 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . 0.46 ' CA ' HD13 ' A' ' 11' ' ' LEU . . . -91.68 -29.57 11.79 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.699 -0.762 . . . . 25.35 112.539 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.6 m -92.57 -10.28 38.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.943 0.401 . . . . 71.15 110.854 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' N ' ' O ' ' A' ' 110' ' ' TYR . 26.2 ttpt -49.43 -60.67 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 71.12 110.894 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -56.13 -39.04 71.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 63.01 110.855 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -60.65 -47.52 85.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 70.23 110.827 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.686 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.0 tm? -69.31 -51.62 35.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.227 -0.442 . . . . 65.03 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.443 ' CG2' ' CE2' ' A' ' 94' ' ' PHE . 78.8 t -56.34 -53.78 35.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 70.44 111.128 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -50.01 -38.73 38.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.44 110.871 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 11.0 m -62.09 -43.53 98.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 43.43 111.159 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.067 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -72.67 -25.96 61.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 61.34 111.058 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.437 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.1 OUTLIER 78.84 39.42 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.203 -0.453 . . . . 71.24 110.888 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.8 mt -92.88 107.12 18.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 64.51 110.922 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.9 t -72.3 -14.14 61.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.179 -0.464 . . . . 71.0 111.098 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -108.5 117.12 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.246 -0.434 . . . . 71.25 110.883 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG13 ' HD2' ' A' ' 94' ' ' PHE . 4.1 t -127.56 113.6 32.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.234 -0.439 . . . . 72.44 111.058 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 19.2 m-85 -111.26 151.76 27.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 73.23 110.886 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -121.08 134.47 55.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 54.51 110.938 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.517 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 7.0 pt -116.73 126.92 74.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.183 -0.462 . . . . 63.11 111.18 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 11.8 tpp180 -73.9 -16.56 61.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 63.5 110.918 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.8 t -170.41 144.18 2.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.1 -0.5 . . . . 64.42 111.097 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 133' ' ' ASP . 68.8 p -40.17 -47.97 2.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 54.3 111.051 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.405 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.4 OUTLIER -38.1 -49.08 1.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 64.12 110.873 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.3 OUTLIER -46.65 -48.07 20.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.224 -0.444 . . . . 74.13 110.817 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.632 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -56.75 84.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 62.03 110.925 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.9 OUTLIER -126.96 152.3 47.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 75.31 111.112 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.418 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.3 tt0 -43.34 -35.66 1.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 73.32 110.891 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.514 HG22 ' HG3' ' A' ' 142' ' ' GLU . 10.6 m -80.05 -60.09 2.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 72.2 111.18 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.517 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.8 t90 -48.93 -21.54 0.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 75.31 110.865 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.799 ' O ' HD22 ' A' ' 140' ' ' LEU . 0.2 OUTLIER -88.93 -57.8 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 74.34 110.887 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.763 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -60.99 -21.36 63.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 65.2 110.891 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.514 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.6 mt-10 -70.5 -45.38 65.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 62.43 110.924 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -62.74 -37.53 86.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.86 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.471 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.1 mt -71.98 -54.6 9.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 71.42 110.877 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -41.04 -78.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.23 111.099 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 147' ' ' GLY . 8.3 t -156.75 33.14 0.31 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 44.34 110.893 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 146' ' ' SER . . . -35.61 148.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.747 -0.74 . . . . 70.24 112.58 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 114.88 3.85 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.666 2.244 . . . . 64.42 112.293 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.2 t -90.89 157.42 17.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.256 -0.429 . . . . 60.31 110.895 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.3 t -88.74 66.66 8.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.204 -0.453 . . . . 73.41 110.853 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.699 -0.763 . . . . 73.32 112.481 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.522 -0.231 . . . . 55.53 112.522 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.47 -57.22 3.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.826 0.346 . . . . 61.12 110.818 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.4 t 68.2 115.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.077 -0.511 . . . . 73.52 110.863 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.68 -87.63 1.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.698 -0.763 . . . . 61.12 112.468 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.62 41.65 3.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.945 0.402 . . . . 73.11 110.866 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.64 104.52 7.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 71.52 110.799 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 63.48 126.06 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.706 -0.759 . . . . 54.54 112.465 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.4 p -99.69 82.73 2.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 73.52 110.869 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -172.23 88.62 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 74.15 110.865 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 84.5 p -125.97 153.92 43.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.49 . . . . 62.44 110.849 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 mt -136.08 -178.04 4.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.3 110.939 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 12' ' ' VAL . 14.4 p -106.33 45.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 62.14 111.141 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.425 HG22 ' N ' ' A' ' 14' ' ' CYS . 7.4 p -36.42 153.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.227 -0.442 . . . . 73.54 111.149 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.425 ' N ' HG22 ' A' ' 13' ' ' VAL . 64.2 m -133.18 -177.97 4.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 72.11 110.924 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -107.38 160.4 15.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 70.14 110.903 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.794 HG21 HG21 ' A' ' 120' ' ' THR . 12.5 p -89.85 100.29 10.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 73.43 111.098 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.487 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.4 t70 -34.02 139.94 0.27 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.623 0.725 . . . . 72.35 110.854 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.6 Cg_endo -69.82 -29.56 23.37 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.687 2.258 . . . . 73.34 112.287 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.487 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.53 -26.48 58.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 73.12 110.848 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.696 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -88.07 -42.89 12.09 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.204 -0.453 . . . . 60.04 110.958 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.472 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.8 ttmt -41.17 -39.13 1.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.939 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.2 mt-10 -71.63 -42.1 68.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 61.21 110.885 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 8.1 m -48.54 -45.08 36.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.121 -0.491 . . . . 52.11 111.091 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.041 HD13 ' HB2' ' A' ' 121' ' ' ALA . 10.6 mt -67.18 -51.44 53.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 72.4 110.955 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 2.9 ttm-85 -55.09 -26.56 38.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.894 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.461 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 2.0 mmtt -86.21 -41.93 14.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 70.44 110.944 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.766 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.3 t80 -56.59 -37.27 70.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.896 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -72.28 -32.05 66.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 62.33 110.878 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -122.46 41.4 3.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 74.14 110.872 -179.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NE ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.71 157.88 24.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 72.33 110.92 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.82 32.7 0.73 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 63.15 110.945 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.472 ' HB2' ' NE ' ' A' ' 30' ' ' ARG . 60.7 mm-40 -104.1 179.06 4.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 65.25 110.906 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.7 p -155.94 22.63 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.22 111.182 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -123.09 -175.66 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 64.22 110.87 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -92.06 126.1 37.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.92 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.78 161.33 37.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.02 111.095 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.23 151.59 50.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 54.24 111.085 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.466 HG23 ' CG ' ' A' ' 54' ' ' GLU . 11.8 mt -132.05 112.92 20.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.131 -0.486 . . . . 54.11 111.129 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.08 112.46 28.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 61.54 111.13 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.749 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.5 mtm -108.58 147.57 31.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 65.02 110.906 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -124.73 175.77 7.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.309 -0.405 . . . . 74.3 110.901 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.789 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -125.25 106.85 16.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.13 111.109 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 47' ' ' GLN . 59.1 m-20 -65.79 122.15 16.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 73.31 110.938 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.0 tttp -68.48 -29.23 67.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.229 -0.441 . . . . 71.31 110.868 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -70.96 -41.23 71.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 74.42 110.92 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' O ' ' C ' ' A' ' 47' ' ' GLN . 16.0 mtp180 -102.75 2.02 35.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 75.14 110.896 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 37.93 49.51 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 71.5 110.808 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.7 ptm -142.27 152.1 42.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 75.55 110.828 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.422 HG11 ' HG ' ' A' ' 117' ' ' LEU . 2.4 t -82.92 107.75 15.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 73.11 111.147 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.405 HG12 ' OD2' ' A' ' 17' ' ' ASP . 26.9 m -117.44 140.79 38.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 71.42 111.096 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.696 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -49.07 150.07 1.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 61.32 110.956 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -121.53 -41.55 2.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 62.42 110.871 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -161.37 168.26 24.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.34 110.776 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.4 mt-10 -152.75 111.62 3.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 73.43 110.848 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.48 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.4 mt -106.55 134.0 50.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.25 110.922 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.487 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 11.5 mp0 -112.46 155.5 24.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.954 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.487 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.1 OUTLIER 50.57 55.61 9.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 65.2 110.876 -179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.95 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.01 140.35 49.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 74.24 111.125 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.503 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.1 OUTLIER -83.58 170.21 14.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.759 0.79 . . . . 61.01 110.793 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.503 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.84 2.72 3.32 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.619 2.213 . . . . 50.01 112.366 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -104.2 -24.6 13.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 75.03 110.875 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -40.31 19.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.48 . . . . 64.12 110.914 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.654 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.25 -55.81 27.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.1 -0.5 . . . . 71.34 110.894 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.86 -38.63 16.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 70.33 110.907 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.3 mt -71.42 -39.14 71.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.991 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.48 ' HG3' HD13 ' A' ' 55' ' ' LEU . 23.8 mm-40 -65.75 -26.31 67.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.195 -0.457 . . . . 65.12 110.853 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.753 HD21 HG21 ' A' ' 75' ' ' VAL . 77.2 mt -79.93 145.45 61.58 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.626 0.726 . . . . 73.51 110.903 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 -179.04 2.63 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.727 2.285 . . . . 75.34 112.343 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.04 -20.26 11.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.35 110.829 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 mmt85 -135.1 40.5 2.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 62.1 110.895 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.424 ' O ' ' CD ' ' A' ' 73' ' ' ARG . 16.3 mt-30 -145.2 102.2 4.41 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.6 0.714 . . . . 73.13 110.932 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.77 133.38 25.4 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.654 2.236 . . . . 72.01 112.333 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -164.02 171.59 15.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 71.45 110.85 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -96.06 146.27 24.78 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.899 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.753 HG21 HD21 ' A' ' 67' ' ' LEU . 31.8 t -145.28 123.72 5.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 50.32 111.111 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.749 HG23 ' HE1' ' A' ' 40' ' ' MET . 44.3 t -108.44 98.62 7.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.138 -0.483 . . . . 64.12 111.109 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -93.15 134.57 35.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.149 -0.478 . . . . 73.22 110.962 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.9 t -114.04 96.39 5.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.501 . . . . 64.12 110.877 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 80' ' ' LYS . 55.7 t80 -84.64 166.13 17.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.41 110.896 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.515 ' N ' ' CD1' ' A' ' 79' ' ' TYR . 5.4 tttt -120.55 108.22 13.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.125 -0.489 . . . . 73.23 110.84 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.95 132.39 50.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.192 -0.458 . . . . 72.32 110.917 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.505 HG22 ' N ' ' A' ' 83' ' ' HIS . 9.6 p -103.41 161.9 4.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.079 -0.509 . . . . 54.13 111.065 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.505 ' N ' HG22 ' A' ' 82' ' ' VAL . 17.6 m-70 -101.27 -82.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 74.44 110.871 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 170.57 -54.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.204 -0.453 . . . . 63.22 110.899 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.67 -12.51 2.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 73.22 110.84 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.97 20.52 3.07 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.73 -0.748 . . . . 73.01 112.44 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -116.05 131.75 56.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.836 0.351 . . . . 71.34 110.883 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.485 ' HB ' HG23 ' A' ' 82' ' ' VAL . 6.5 p -136.83 130.87 46.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 72.2 111.106 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 63.5 m -125.67 155.78 40.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 51.2 110.859 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.403 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.1 m-85 -105.04 95.12 8.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.648 0.737 . . . . 75.21 110.914 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.5 Cg_endo -69.68 94.08 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.655 2.237 . . . . 71.44 112.381 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.766 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.49 126.19 29.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.41 110.949 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.479 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 80.7 m -125.04 167.55 14.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.243 -0.435 . . . . 64.35 110.862 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.545 ' CG ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -111.54 103.41 11.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 70.35 110.888 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.2 mt -93.65 113.37 28.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.467 . . . . 74.44 111.106 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.482 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.3 t80 -96.31 102.07 13.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.923 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.3 t -79.4 95.66 5.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.34 110.813 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.5 t -127.26 94.0 39.78 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.78 0.8 . . . . 75.43 110.908 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.69 165.15 31.87 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.751 2.301 . . . . 71.52 112.341 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.6 p -104.44 18.75 4.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 65.41 111.015 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -111.35 -5.05 26.74 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.794 -0.717 . . . . 74.45 112.509 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -86.8 -175.12 5.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.818 0.342 . . . . 52.44 110.942 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.68 150.1 43.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.531 0.681 . . . . 72.23 110.821 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -10.11 27.75 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.726 2.284 . . . . 75.34 112.309 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -78.24 -30.25 48.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.245 -0.434 . . . . 63.01 110.876 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.3 mm100 -92.65 -58.59 2.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 73.14 110.911 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.15 -35.86 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 65.45 110.899 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 25.8 mtm -71.87 -44.86 63.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.45 . . . . 61.51 110.85 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 74.5 mtp -46.19 -35.23 4.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 54.21 110.872 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.789 ' CE2' HG12 ' A' ' 42' ' ' VAL . 17.1 m-85 -93.46 -35.61 12.88 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.33 110.952 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -28.94 70.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.092 -0.503 . . . . 51.12 111.104 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -90.02 -34.68 8.08 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.74 . . . . 62.15 112.482 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.1 m -90.67 -2.24 57.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.009 0.433 . . . . 72.25 110.956 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.482 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 31.5 ttpt -55.94 -67.26 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.069 -0.514 . . . . 71.14 110.877 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -49.66 -38.02 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 73.21 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -47.74 81.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 73.13 110.895 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.495 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.5 tm? -67.23 -49.27 65.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 64.41 110.898 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.545 HG22 ' CG ' ' A' ' 94' ' ' PHE . 52.7 t -58.11 -54.15 36.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 45.43 111.181 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -49.42 -36.58 22.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 73.42 110.945 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.794 HG21 HG21 ' A' ' 16' ' ' VAL . 10.7 m -65.33 -43.72 90.03 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.187 -0.461 . . . . 71.2 111.169 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.041 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.38 -24.42 62.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.202 -0.454 . . . . 73.05 111.083 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.19 35.62 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.24 -0.436 . . . . 64.23 110.91 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.43 HD13 ' HB2' ' A' ' 94' ' ' PHE . 6.5 mt -91.09 98.28 11.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.11 -0.495 . . . . 32.42 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 9.3 t -59.32 -20.88 58.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.212 -0.449 . . . . 74.25 111.086 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mtmm -100.13 115.71 30.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 65.22 110.878 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 16.6 t -124.34 109.86 23.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.24 111.139 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 22.7 m-85 -113.02 114.4 26.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.119 -0.492 . . . . 71.2 110.84 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.55 112.9 24.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 75.32 110.908 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.6 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.7 pt -96.72 132.56 40.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 61.13 111.078 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -77.8 -17.2 57.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.489 . . . . 74.31 110.872 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.5 t -161.2 158.09 26.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.222 -0.445 . . . . 75.44 111.19 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 37.0 p -63.88 -42.44 97.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.262 -0.426 . . . . 62.25 111.085 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.38 -33.93 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 70.42 110.922 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.02 -45.28 89.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 75.4 110.918 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.654 HD21 ' HB3' ' A' ' 63' ' ' LEU . 1.6 tp -58.18 90.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.452 . . . . 73.42 110.862 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.37 153.27 51.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 70.43 111.096 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.9 tt0 -43.09 -36.81 1.77 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.854 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 4.4 m -79.8 -66.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.157 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.6 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.2 t90 -43.73 -24.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 63.45 110.955 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.693 HD13 ' N ' ' A' ' 141' ' ' LYS . 1.1 tm? -85.2 -59.04 2.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 62.31 110.984 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.693 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.17 -25.52 59.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.168 -0.469 . . . . 73.33 110.924 179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.4 -41.29 80.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.248 -0.433 . . . . 61.02 110.841 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.8 mmtt -67.58 -37.25 82.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.118 -0.492 . . . . 65.52 110.886 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.479 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 14.3 mt -72.04 -51.44 21.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 62.01 110.919 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -40.87 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 73.22 111.062 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.52 69.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 72.0 110.794 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 56.15 172.95 0.15 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.733 -0.746 . . . . 72.2 112.494 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 106.23 1.63 Allowed 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.727 2.285 . . . . 72.33 112.315 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.07 158.77 17.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 65.04 110.893 -179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 68.0 m -39.18 132.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 74.41 110.892 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.758 -0.734 . . . . 74.14 112.469 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.371 0 N-CA-C 112.5 -0.24 . . . . 64.53 112.5 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -124.55 161.57 25.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.937 0.398 . . . . 64.32 110.818 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m 61.01 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 71.45 110.9 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -117.93 -61.86 0.3 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.802 -0.713 . . . . 41.31 112.478 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.78 109.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.842 0.353 . . . . 70.31 110.866 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.5 t -135.72 -46.41 0.67 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 71.34 110.839 -179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.1 108.31 0.27 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 35.11 112.499 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.6 t -129.16 175.12 8.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 54.33 110.784 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.8 79.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.061 -0.518 . . . . 73.53 110.885 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 53.95 174.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 63.41 110.846 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.2 mt -143.8 -174.79 4.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.12 -0.491 . . . . 71.22 110.97 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.421 HG21 ' HG2' ' A' ' 109' ' ' MET . 2.6 t -92.04 42.16 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 74.41 111.113 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.5 t -41.25 106.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 75.32 111.148 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 99.1 m -98.65 -178.5 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 72.15 110.9 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -110.34 152.7 25.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 74.55 110.89 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.699 HG13 ' O ' ' A' ' 16' ' ' VAL . 11.9 p -81.19 98.68 4.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.43 111.144 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.5 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.2 t70 -33.06 140.4 0.22 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.64 0.733 . . . . 61.32 110.834 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.438 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.4 Cg_endo -69.83 -30.42 21.99 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.699 2.266 . . . . 73.4 112.307 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.5 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.67 -26.05 61.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.897 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.605 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -88.3 -37.86 15.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.13 -0.486 . . . . 73.22 110.93 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.486 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.0 ttmt -44.25 -45.27 8.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 74.42 110.893 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 4.5 mt-10 -65.98 -45.79 80.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 74.42 110.894 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -46.88 -49.52 20.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.475 . . . . 75.34 111.18 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.966 HD13 ' HB2' ' A' ' 121' ' ' ALA . 21.3 mt -61.67 -53.72 52.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.183 -0.462 . . . . 55.31 110.931 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.0 ttm-85 -51.26 -28.89 12.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 73.12 110.848 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.8 OUTLIER -87.11 -39.71 15.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 75.52 110.863 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.737 ' CD2' HD21 ' A' ' 92' ' ' LEU . 16.7 t80 -61.08 -21.9 64.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 74.22 110.909 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.476 ' CZ ' ' HB3' ' A' ' 122' ' ' GLU . 8.1 mtm180 -84.33 -34.07 23.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 64.03 110.867 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.429 ' CD1' ' N ' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -121.66 41.86 3.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 63.42 110.892 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -94.2 -177.11 4.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.109 -0.496 . . . . 71.21 110.804 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 33' ' ' THR . 6.9 mptt -60.69 -13.48 14.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.174 -0.467 . . . . 64.32 110.913 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 7.4 mt-10 33.57 -134.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.919 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.839 HG22 ' OH ' ' A' ' 90' ' ' TYR . 2.6 p 51.03 16.97 0.39 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 54.44 111.151 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER -155.75 119.92 4.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 54.23 110.9 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 57' ' ' ASN . 93.8 m-20 -54.36 120.62 6.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 70.4 110.848 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.48 160.53 39.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.462 . . . . 73.32 111.1 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.2 142.98 33.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 71.41 111.1 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.412 HD11 ' CD1' ' A' ' 27' ' ' PHE . 5.8 mt -122.92 106.01 16.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 74.02 111.152 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.4 mt -89.08 114.38 27.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 63.34 111.158 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.684 ' SD ' HD21 ' A' ' 117' ' ' LEU . 1.3 mtm -110.4 150.76 28.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 53.4 110.878 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 16.0 pttt -131.04 175.83 8.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.867 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.864 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.37 117.2 48.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 64.54 111.125 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.462 ' O ' ' N ' ' A' ' 47' ' ' GLN . 8.5 m-20 -79.3 119.47 22.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 72.52 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -23.04 65.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.21 -0.45 . . . . 63.33 110.964 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -37.38 68.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.22 110.878 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.3 mtp180 -111.23 1.98 17.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.821 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.4 mm-40 40.07 54.81 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 63.24 110.912 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.408 ' CG ' HG13 ' A' ' 50' ' ' VAL . 3.1 ptm -146.98 152.59 38.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.822 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.439 HG11 HD13 ' A' ' 117' ' ' LEU . 7.3 t -85.43 105.98 14.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 52.24 111.187 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.0 m -116.14 137.38 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 63.44 111.133 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.4 tt -46.26 145.5 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 64.23 110.896 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -114.67 -39.78 3.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 71.14 110.895 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -163.16 161.47 25.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 72.21 110.869 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 51' ' ' LEU . 7.1 mt-10 -146.64 111.64 5.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.862 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.405 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 15.1 mt -113.0 135.44 53.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.13 110.862 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.475 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 9.3 mp0 -114.6 157.52 22.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 51.15 110.897 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.475 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.97 53.48 12.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 71.22 110.879 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.96 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.46 139.56 51.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 72.03 111.124 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.481 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.76 169.25 19.39 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.702 0.763 . . . . 62.21 110.825 -179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.2 Cg_endo -69.81 1.39 4.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.642 2.228 . . . . 61.04 112.305 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -101.28 -27.03 13.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.246 -0.433 . . . . 55.04 110.893 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -81.78 -41.81 20.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.216 -0.447 . . . . 75.34 110.846 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.618 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.1 OUTLIER -53.7 -54.18 41.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.13 -0.486 . . . . 75.53 110.937 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.64 -47.02 40.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 71.04 110.916 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.6 mt -63.85 -31.99 73.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 64.54 110.942 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.405 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 15.8 mm-40 -68.72 -35.42 77.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 64.02 110.934 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.822 HD21 HG21 ' A' ' 75' ' ' VAL . 67.7 mt -65.06 155.45 83.94 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.626 0.726 . . . . 71.41 110.87 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.493 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.6 Cg_endo -69.76 -170.69 0.41 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.6 2.2 . . . . 53.21 112.366 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -103.78 -33.25 8.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 53.33 110.925 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -147.62 50.39 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.092 -0.504 . . . . 74.1 110.795 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.493 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -134.36 111.52 11.77 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.619 0.724 . . . . 73.35 110.923 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.69 136.1 32.3 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.708 2.272 . . . . 73.14 112.363 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.16 168.44 11.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 74.15 110.874 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 117' ' ' LEU . 19.8 m-85 -96.2 150.09 20.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.887 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.822 HG21 HD21 ' A' ' 67' ' ' LEU . 96.5 t -152.07 124.6 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 41.31 111.079 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.623 HG23 ' HE1' ' A' ' 40' ' ' MET . 47.9 t -109.66 101.82 13.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.167 -0.47 . . . . 72.44 111.081 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -93.29 138.37 31.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.167 -0.469 . . . . 73.44 110.937 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.1 t -119.92 96.56 5.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 70.22 110.842 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.401 ' HB2' HD21 ' A' ' 140' ' ' LEU . 49.2 t80 -88.0 154.93 20.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.872 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -107.16 108.14 19.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 73.41 110.875 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.36 131.67 46.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.944 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.491 HG13 ' HB ' ' A' ' 88' ' ' VAL . 3.6 t -102.56 147.7 8.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 73.11 111.106 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 20.5 m-70 -82.82 -86.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 63.32 110.852 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.434 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 165.98 -30.93 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.405 . . . . 72.05 110.889 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -81.18 -15.47 55.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 75.4 110.851 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.97 10.95 2.39 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.799 -0.715 . . . . 54.45 112.423 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.0 mmt85 -115.31 134.25 55.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.819 0.343 . . . . 75.25 110.894 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HB ' HG13 ' A' ' 82' ' ' VAL . 1.7 p -129.82 127.22 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 74.34 111.155 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 11.9 m -119.99 148.94 42.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 74.22 110.827 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.839 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.1 OUTLIER -107.61 95.05 13.14 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 121.683 0.754 . . . . 72.55 110.854 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.575 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.81 97.41 0.64 Allowed 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.642 2.228 . . . . 73.53 112.312 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.737 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.49 123.07 23.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 74.41 110.941 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.499 ' SG ' HD21 ' A' ' 144' ' ' LEU . 73.3 m -121.76 156.22 33.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 75.34 110.913 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.588 ' HB2' HD13 ' A' ' 123' ' ' LEU . 63.4 t80 -102.34 105.62 16.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 73.43 110.876 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.1 mt -93.31 125.85 45.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 72.31 111.118 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.413 ' C ' ' CD1' ' A' ' 96' ' ' PHE . 1.3 t80 -109.83 111.58 23.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 64.43 110.941 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.5 t -78.45 99.86 6.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 52.33 110.826 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -128.11 94.08 37.4 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.685 0.755 . . . . 72.22 110.809 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -163.35 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.737 2.291 . . . . 63.51 112.336 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.1 t -123.58 -38.61 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 74.32 111.121 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -73.67 6.77 16.31 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.749 -0.739 . . . . 60.13 112.485 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 7.9 p -79.19 -173.96 3.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.863 0.363 . . . . 61.2 110.924 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.65 147.02 34.56 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.526 0.679 . . . . 75.44 110.918 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.85 -17.34 37.23 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.68 2.253 . . . . 62.41 112.276 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -70.67 -37.64 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.247 -0.433 . . . . 75.43 110.922 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.1 mm100 -89.36 -58.91 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.959 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.42 -39.1 0.27 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.213 -0.449 . . . . 73.42 110.89 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.1 mtm -63.82 -42.89 97.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.22 110.834 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -54.35 -30.87 53.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.273 -0.422 . . . . 72.41 110.944 179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.864 ' CE2' HG12 ' A' ' 42' ' ' VAL . 40.0 m-85 -95.6 -32.82 12.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.31 110.869 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.69 -29.67 69.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 50.01 111.114 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.05 -20.59 27.71 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.685 -0.769 . . . . 71.32 112.497 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -100.88 -13.91 18.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.924 0.393 . . . . 61.34 110.829 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 74' ' ' PHE . 13.7 ttpt -48.64 -54.75 13.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 73.22 110.93 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -56.37 -42.46 77.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 74.05 110.858 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -54.73 -56.46 18.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 74.34 110.857 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 74' ' ' PHE . 18.6 tp -59.83 -59.3 5.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 64.3 110.933 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.59 HG11 HG21 ' A' ' 126' ' ' VAL . 80.2 t -47.76 -54.15 3.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 75.41 111.175 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -50.15 -43.6 52.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.145 -0.479 . . . . 72.12 110.922 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.644 HG21 HG21 ' A' ' 16' ' ' VAL . 9.3 m -57.98 -44.7 87.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 74.0 111.106 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.966 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.77 -26.2 64.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 73.21 111.072 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.476 ' HB3' ' CZ ' ' A' ' 28' ' ' ARG . 14.1 tt0 75.99 34.57 0.53 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.89 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.588 HD13 ' HB2' ' A' ' 94' ' ' PHE . 3.6 mt -87.87 114.48 24.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 52.21 110.964 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 5.7 m -65.99 -48.55 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.185 -0.461 . . . . 71.43 111.109 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mttm -80.06 125.21 29.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.246 -0.433 . . . . 63.43 110.959 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.59 HG21 HG11 ' A' ' 118' ' ' VAL . 71.4 t -134.68 103.61 4.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.109 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -97.33 161.83 13.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.188 -0.46 . . . . 73.02 110.871 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 122.41 18.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.483 . . . . 71.23 110.855 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.0 pt -100.93 134.42 41.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 72.52 111.092 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.5 tpp85 -82.89 -8.99 59.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 52.11 110.868 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.9 t -171.92 145.15 1.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 73.31 111.093 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 p -45.67 -42.74 11.92 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 72.14 111.187 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.79 -37.41 8.58 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.187 -0.46 . . . . 65.2 110.869 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 136' ' ' THR . 83.5 m-20 -52.94 -58.86 5.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.33 110.838 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.618 HD21 ' HB3' ' A' ' 63' ' ' LEU . 5.7 tp -45.43 95.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.51 110.96 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.401 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -134.4 145.2 48.71 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 72.55 111.051 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.461 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 12.3 tt0 -39.94 -45.96 1.96 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 71.32 110.92 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 140' ' ' LEU . 7.8 m -69.52 -63.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.495 . . . . 55.41 111.139 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -41.36 -25.41 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.226 -0.443 . . . . 73.11 110.974 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' A' ' 138' ' ' THR . 8.8 tp -85.54 -65.95 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.465 . . . . 75.44 110.907 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.13 -19.27 1.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.291 -0.413 . . . . 64.32 110.925 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -67.37 -54.91 16.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 74.3 110.926 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -63.12 -38.12 89.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 63.51 110.85 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.575 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.0 mt -66.0 -47.98 72.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 74.43 110.912 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.55 -68.77 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.127 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -171.11 38.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 71.45 110.819 -179.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 90.21 146.39 15.39 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.793 -0.717 . . . . 52.11 112.436 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.87 -171.97 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.64 2.227 . . . . 74.32 112.29 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 37.9 t -87.18 128.41 35.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 70.34 110.89 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -169.06 91.89 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 72.23 110.867 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.676 -0.773 . . . . 64.1 112.43 -179.976 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.46 -0.256 . . . . 71.42 112.46 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 m 58.27 110.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.905 0.383 . . . . 65.42 110.845 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 97.4 3.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 63.12 110.924 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -163.41 106.4 0.28 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.736 -0.745 . . . . 72.34 112.477 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.39 163.87 12.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.841 0.353 . . . . 74.33 110.855 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.4 t -97.5 89.57 4.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.116 -0.493 . . . . 52.3 110.873 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 55.84 95.38 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.777 -0.725 . . . . 70.12 112.466 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.8 p 177.16 166.49 0.57 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.837 0.351 . . . . 42.4 110.817 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 64.96 119.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.816 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.416 ' C ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 p -67.9 139.37 56.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.475 . . . . 55.42 110.881 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.416 ' HG ' ' C ' ' A' ' 10' ' ' SER . 4.4 mt -146.73 -164.58 2.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 71.4 110.928 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.411 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.2 t -101.65 38.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 74.11 111.086 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.411 ' C ' ' O ' ' A' ' 12' ' ' VAL . 89.7 t -36.2 103.71 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.224 -0.444 . . . . 72.43 111.149 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.27 -177.73 3.61 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.176 -0.465 . . . . 73.21 110.874 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -107.39 168.66 9.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.195 -0.457 . . . . 64.13 110.872 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.448 ' O ' ' C ' ' A' ' 17' ' ' ASP . 93.4 t -98.64 104.03 15.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 63.45 111.137 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.501 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.8 t70 -34.28 140.89 0.26 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.641 0.734 . . . . 60.13 110.85 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.8 Cg_endo -69.7 -29.73 23.7 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.734 2.289 . . . . 61.2 112.297 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -76.12 -25.92 55.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 73.44 110.839 -179.938 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.664 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.0 tt -88.94 -41.56 12.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.186 -0.461 . . . . 72.34 110.861 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -40.63 -44.67 2.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.211 -0.45 . . . . 64.14 110.87 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.9 mt-10 -65.89 -44.15 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.291 -0.413 . . . . 71.31 110.91 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.475 ' HB ' HD23 ' A' ' 20' ' ' LEU . 3.5 m -48.4 -38.25 19.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 75.34 111.1 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.066 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.5 mt -70.57 -52.82 19.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.304 -0.407 . . . . 75.14 110.923 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 6.2 ttm180 -57.92 -32.4 67.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 74.04 110.884 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.3 mmtt -79.89 -38.74 31.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 74.2 110.94 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 5.2 t80 -58.73 -38.68 78.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 75.04 110.948 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -73.76 -28.52 61.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 62.43 110.882 -179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.596 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -126.07 40.87 3.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.188 -0.46 . . . . 74.02 110.877 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -78.72 172.18 14.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.907 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.62 37.82 1.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.42 110.918 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 7.7 mm-40 -110.89 178.35 4.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.913 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 72.6 p -153.53 29.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.169 -0.468 . . . . 72.42 111.137 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -133.71 174.39 10.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 72.43 110.884 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -77.51 125.91 30.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.177 -0.465 . . . . 70.1 110.863 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.95 43.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 74.11 111.095 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.439 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -137.37 151.53 48.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 73.14 111.115 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 mt -132.17 108.31 13.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 73.45 111.106 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.0 113.5 26.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 63.33 111.094 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.766 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -110.82 145.6 37.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 70.34 110.881 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -123.63 176.82 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 73.54 110.912 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.861 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -128.5 113.22 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 71.45 111.119 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 29.6 m-20 -74.38 118.91 17.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 60.42 110.875 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.8 tttt -64.08 -22.8 67.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.189 -0.46 . . . . 63.24 110.924 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.46 -42.25 53.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 73.14 110.878 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 47' ' ' GLN . 30.6 mtp180 -102.36 4.8 39.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 75.52 110.837 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.3 mm-40 35.76 50.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.263 -0.426 . . . . 73.0 110.901 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 ptm -145.65 155.13 42.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.23 110.922 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.0 t -87.53 113.62 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 74.13 111.175 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.7 m -122.01 140.78 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.132 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.784 HD11 ' HG3' ' A' ' 54' ' ' GLU . 0.9 OUTLIER -49.25 144.39 5.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 42.1 110.875 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.4 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 4.1 tp10 -116.3 -43.37 2.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 64.41 110.93 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -158.18 162.14 37.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 73.35 110.799 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.784 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.7 mt-10 -145.26 110.85 5.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 52.52 110.912 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 66' ' ' GLU . 4.2 mt -108.43 130.37 55.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.867 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.484 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 16.3 mp0 -110.88 159.53 17.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 73.24 110.873 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.484 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.13 55.74 6.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 63.24 110.92 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.961 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.33 138.28 55.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 62.03 111.116 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.492 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.53 169.85 17.39 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 121.643 0.735 . . . . 73.32 110.905 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.492 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.8 Cg_endo -69.77 3.32 2.84 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.658 2.239 . . . . 74.31 112.349 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -104.78 -21.0 13.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.949 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -87.16 -43.8 11.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.496 . . . . 72.24 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.672 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.0 -51.46 57.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.187 -0.46 . . . . 74.13 110.898 179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.25 -41.74 60.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.41 110.877 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.3 mt -67.65 -36.7 81.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.254 -0.43 . . . . 74.12 110.894 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' HD13 ' A' ' 55' ' ' LEU . 66.0 mm-40 -65.73 -32.28 73.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.191 -0.459 . . . . 72.34 110.901 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.849 HD21 HG21 ' A' ' 75' ' ' VAL . 53.8 mt -71.12 151.8 94.73 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.553 0.692 . . . . 72.05 110.987 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.437 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.74 -166.5 0.19 Allowed 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.668 2.245 . . . . 62.21 112.323 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -115.49 -19.41 10.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.244 -0.434 . . . . 75.34 110.861 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -152.54 46.61 0.73 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.112 -0.495 . . . . 70.54 110.899 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.437 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 1.2 mt-30 -136.34 105.84 9.34 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.618 0.723 . . . . 63.35 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 52.7 Cg_endo -69.84 129.88 18.27 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.691 2.261 . . . . 74.03 112.291 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.434 ' CZ ' ' HD3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -162.12 174.08 13.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.433 . . . . 65.42 110.897 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.403 ' CD2' HD22 ' A' ' 117' ' ' LEU . 29.5 m-85 -98.35 148.96 23.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.841 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.849 HG21 HD21 ' A' ' 67' ' ' LEU . 22.4 t -153.12 121.02 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.117 -0.492 . . . . 60.01 111.05 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.766 HG23 ' HE1' ' A' ' 40' ' ' MET . 69.5 t -106.23 98.29 6.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 75.24 111.153 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.507 ' HB2' HD12 ' A' ' 95' ' ' ILE . 14.3 t80 -90.81 134.15 34.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.932 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 18.6 t -113.8 96.44 5.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.053 -0.521 . . . . 61.41 110.854 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.546 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 61.8 t80 -84.69 167.65 15.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.139 -0.482 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.546 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 19.5 ttpt -118.35 111.62 18.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 74.32 110.919 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.97 132.65 53.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.215 -0.448 . . . . 75.04 110.947 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.427 HG12 ' N ' ' A' ' 83' ' ' HIS . 40.3 t -95.2 155.08 3.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 73.54 111.105 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.427 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.0 m-70 -91.21 -84.21 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 71.0 110.815 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.412 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.5 OUTLIER 166.67 -39.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 62.44 110.808 179.956 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -72.38 -14.09 61.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.879 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.99 13.8 2.89 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.853 -0.689 . . . . 24.31 112.506 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -115.29 141.33 48.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.9 0.381 . . . . 74.22 110.886 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.7 p -138.96 124.74 22.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.22 111.144 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.7 m -118.08 159.27 23.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.164 -0.471 . . . . 75.1 110.859 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 3.4 m-85 -106.43 95.34 11.48 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.73 0.776 . . . . 75.31 110.894 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.9 Cg_endo -69.79 97.34 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.705 2.27 . . . . 65.23 112.354 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.17 132.15 43.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 75.43 110.94 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 72.5 m -132.05 153.94 49.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.888 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 123' ' ' LEU . 61.0 t80 -96.1 105.82 17.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.243 -0.435 . . . . 72.52 110.895 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 77' ' ' TYR . 83.4 mt -93.68 117.58 37.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 73.22 111.084 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.446 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.1 t80 -101.22 107.32 18.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.142 -0.481 . . . . 75.52 110.878 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.5 t -79.22 95.47 5.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 52.14 110.812 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.405 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -122.14 93.83 48.35 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.653 0.74 . . . . 62.34 110.898 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 54.3 Cg_endo -69.7 -163.65 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.735 2.29 . . . . 72.31 112.336 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.8 t -123.35 -30.45 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.093 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.64 4.59 42.8 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.749 -0.739 . . . . 64.03 112.487 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.4 p -83.18 -177.58 6.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 71.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.68 150.66 38.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.56 0.695 . . . . 75.31 110.98 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 -14.14 35.53 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.644 2.229 . . . . 73.31 112.378 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.68 -35.19 62.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.445 . . . . 72.31 110.946 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.6 mm100 -89.66 -59.59 2.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.137 -0.483 . . . . 52.42 110.995 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.418 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.07 -39.76 0.18 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.935 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.5 mtm -65.2 -44.99 86.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 74.05 110.885 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.491 ' N ' ' O ' ' A' ' 106' ' ' GLN . 77.8 mtp -48.99 -33.28 10.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.28 -0.418 . . . . 72.34 110.903 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.861 ' CE2' HG12 ' A' ' 42' ' ' VAL . 20.9 m-85 -95.52 -35.74 11.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.236 -0.438 . . . . 75.15 110.876 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.31 -27.44 68.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 72.31 111.172 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.04 -29.33 9.12 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.652 -0.785 . . . . 63.31 112.47 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -94.42 -9.88 34.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.936 0.398 . . . . 62.25 110.836 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.534 ' O ' HG23 ' A' ' 118' ' ' VAL . 24.2 ttpt -54.39 -66.23 0.44 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 62.14 110.927 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 61.2 m-80 -53.89 -40.52 66.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.457 . . . . 65.4 110.849 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -57.31 -54.04 51.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.881 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.439 HD12 HG22 ' A' ' 16' ' ' VAL . 7.3 tp -64.19 -58.9 5.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 70.11 110.846 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 114' ' ' LYS . 85.6 t -40.29 -50.88 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 70.3 111.15 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.63 -44.19 62.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 64.13 110.878 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 20.0 m -59.49 -44.42 93.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 72.55 111.162 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.066 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -65.85 -20.1 66.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 50.31 111.063 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 71.16 45.53 0.49 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.292 -0.413 . . . . 64.13 110.884 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 94' ' ' PHE . 12.6 mt -101.39 111.37 23.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.918 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -76.19 -12.62 60.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.454 . . . . 55.04 111.215 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -111.45 124.43 52.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.482 . . . . 71.15 110.864 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.54 132.86 54.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.223 -0.444 . . . . 74.14 111.159 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -131.59 140.86 49.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.117 -0.492 . . . . 54.24 110.884 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -114.75 123.74 50.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 73.52 110.903 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -109.47 128.49 65.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 73.01 111.161 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 11.1 tpp85 -77.93 -9.85 59.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.839 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -169.57 148.19 3.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 52.42 111.166 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 50.7 p -50.88 -39.96 55.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 73.22 111.191 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -46.9 -35.3 6.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.938 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.571 ' OD2' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -59.49 -40.54 87.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.199 -0.455 . . . . 73.24 110.867 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.5 tp -65.77 89.79 0.11 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 65.2 110.954 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.1 p -132.19 149.91 52.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 71.33 111.123 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.474 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.3 tt0 -39.32 -39.88 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 63.21 110.872 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.533 HG22 ' HG3' ' A' ' 142' ' ' GLU . 7.4 m -76.43 -65.19 0.96 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 72.14 111.163 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.571 ' CD1' ' OD2' ' A' ' 134' ' ' ASP . 2.2 t90 -43.82 -23.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 74.55 110.93 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.769 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -86.29 -59.18 2.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.13 110.922 179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.769 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.6 mtpm? -60.63 -18.2 51.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.246 -0.434 . . . . 75.15 110.903 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.533 ' HG3' HG22 ' A' ' 138' ' ' THR . 4.7 mt-10 -72.6 -47.57 46.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 65.55 110.942 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.49 -33.78 75.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.462 . . . . 75.01 110.903 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 13.6 mt -75.49 -50.17 16.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 64.34 110.853 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.64 -62.78 1.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 70.42 111.133 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.96 39.78 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 73.33 110.903 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -52.42 154.27 5.66 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.728 -0.749 . . . . 52.12 112.461 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 101.94 0.96 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.663 2.242 . . . . 62.11 112.4 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.9 175.29 7.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 63.44 110.826 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.72 103.1 10.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.094 -0.503 . . . . 62.41 110.819 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.773 -0.727 . . . . 70.42 112.415 -179.959 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.402 ' O ' ' HB1' ' A' ' 111' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.47 -0.252 . . . . 44.04 112.47 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.1 p -127.86 163.12 25.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.842 0.354 . . . . 75.25 110.856 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 75.4 m -80.82 -54.0 5.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.132 -0.485 . . . . 53.22 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.17 98.46 1.27 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 73.11 112.495 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.49 -67.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.886 0.374 . . . . 61.24 110.801 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 p -176.11 157.98 1.9 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 65.24 110.866 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 179.42 -135.93 2.67 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.768 -0.73 . . . . 55.14 112.502 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 t -151.59 154.05 35.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.903 0.382 . . . . 60.45 110.908 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.41 45.44 0.96 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.157 -0.474 . . . . 72.45 110.954 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 m -162.41 131.76 4.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 65.43 110.867 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 mt -135.85 -175.01 3.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 73.3 110.906 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 12' ' ' VAL . 9.0 p -95.87 44.44 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.167 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.7 p -39.52 149.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.09 -0.505 . . . . 74.3 111.136 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 1.026 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.5 OUTLIER -119.7 -170.88 2.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 54.22 110.921 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -121.51 142.61 49.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.22 110.92 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.949 HG21 HG21 ' A' ' 120' ' ' THR . 6.8 p -69.02 94.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.115 -0.493 . . . . 73.22 111.131 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.505 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.0 t70 -33.54 140.7 0.23 Allowed Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.64 0.733 . . . . 74.22 110.858 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.78 -32.13 19.08 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.651 2.234 . . . . 72.22 112.37 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.505 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -71.89 -26.26 62.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 64.25 110.805 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.722 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.9 tt -89.84 -43.97 10.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.225 -0.443 . . . . 65.4 110.918 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.464 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.6 ttmt -38.91 -44.39 1.06 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 73.33 110.885 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.471 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.3 mt-10 -65.26 -45.98 82.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 70.04 110.878 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -46.22 -45.94 17.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 63.54 111.173 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.08 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.2 mt -62.81 -49.34 75.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 64.44 110.907 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.505 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.7 OUTLIER -60.74 -32.03 71.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 62.44 110.895 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 3.2 mttt -80.64 -31.91 36.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 55.1 110.905 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.719 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.4 t80 -67.23 -38.87 85.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.928 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.7 mtm180 -68.4 -28.69 67.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 62.25 110.895 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.574 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.82 40.49 3.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.222 -0.445 . . . . 73.44 110.85 -179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.429 ' HD2' ' CD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -71.55 166.29 22.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 72.4 110.841 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -96.35 34.51 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 63.34 110.972 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -114.08 179.0 4.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 64.02 110.873 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 67.0 p -149.02 20.3 0.98 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.182 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -122.78 -179.8 4.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.243 -0.435 . . . . 61.44 110.879 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -81.68 137.39 35.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 72.3 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.74 156.8 42.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 72.11 111.108 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -133.79 154.77 50.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 62.2 111.137 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.547 HG23 ' CG ' ' A' ' 54' ' ' GLU . 12.8 mt -136.06 106.63 5.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 64.51 111.132 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.7 mt -89.75 119.45 36.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 74.21 111.161 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.722 ' HG2' HD11 ' A' ' 20' ' ' LEU . 0.6 OUTLIER -113.72 145.97 40.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 61.22 110.871 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -123.28 176.78 5.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 71.45 110.889 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.614 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.1 OUTLIER -126.43 107.0 16.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 65.04 111.118 179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 93.5 m-20 -62.07 121.43 13.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 73.2 110.938 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -74.92 0.27 16.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 51.15 110.931 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -102.53 -28.86 11.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.472 . . . . 64.42 110.931 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -114.3 -3.92 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.0 110.835 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 46.6 55.49 7.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 73.33 110.933 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.462 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.3 ptm -150.31 139.2 20.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.271 -0.422 . . . . 73.3 110.94 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 1.026 HG23 ' SG ' ' A' ' 14' ' ' CYS . 38.0 t -74.42 100.64 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 72.4 111.15 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.462 HG13 ' CG ' ' A' ' 48' ' ' MET . 33.5 m -110.84 143.04 21.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.173 -0.467 . . . . 74.01 111.104 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.633 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.9 tt -44.87 145.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 75.32 110.95 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -118.42 -37.3 3.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.33 110.835 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -165.63 162.9 19.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.237 -0.438 . . . . 61.34 110.877 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.547 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.4 mt-10 -147.65 111.97 5.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.191 -0.459 . . . . 70.12 110.896 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 HD13 ' HG3' ' A' ' 66' ' ' GLU . 3.6 mt -110.33 134.75 51.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.13 -0.486 . . . . 43.4 110.898 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -114.82 160.67 19.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 72.42 110.963 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 16.9 m-80 46.51 53.03 10.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 72.1 110.888 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.948 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.02 140.6 48.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.138 -0.483 . . . . 65.21 111.153 179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.482 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -84.63 169.19 17.36 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 121.606 0.717 . . . . 43.24 110.897 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.482 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.2 Cg_endo -69.75 2.47 3.5 Favored 'Trans proline' 0 C--N 1.34 0.105 0 C-N-CA 122.702 2.268 . . . . 62.35 112.3 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -102.24 -23.5 14.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 75.03 110.891 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.88 -43.97 12.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 71.53 110.883 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.639 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -51.36 -49.53 61.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 61.1 110.908 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 -33.07 49.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 73.12 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.3 mt -74.7 -39.45 61.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 61.14 110.935 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.488 ' HG3' HD13 ' A' ' 55' ' ' LEU . 16.8 mm-40 -66.31 -24.44 66.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 70.12 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.867 HD21 HG21 ' A' ' 75' ' ' VAL . 84.5 mt -78.7 147.77 71.68 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.577 0.703 . . . . 71.43 110.958 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD3' ' CZ ' ' A' ' 73' ' ' ARG . 54.7 Cg_endo -69.72 -169.84 0.35 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.726 2.284 . . . . 62.22 112.318 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -125.86 -13.54 6.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 74.21 110.843 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -142.88 20.18 1.97 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.42 110.908 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 3.6 mt-30 -126.51 106.2 23.83 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.605 0.717 . . . . 55.24 111.0 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.519 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.71 136.43 33.11 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.703 2.269 . . . . 75.03 112.388 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.581 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -163.99 167.23 20.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 73.32 110.887 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.572 ' CZ ' ' HA ' ' A' ' 114' ' ' LYS . 37.1 m-85 -97.67 151.49 20.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 72.14 110.938 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.867 HG21 HD21 ' A' ' 67' ' ' LEU . 39.6 t -152.92 132.4 3.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 53.13 111.171 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.695 HG23 ' HE1' ' A' ' 40' ' ' MET . 62.1 t -113.22 96.05 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 72.43 111.152 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -87.18 138.73 31.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.464 . . . . 70.24 110.892 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.0 t -116.0 97.21 5.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.09 -0.505 . . . . 62.52 110.851 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.591 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.2 t80 -86.82 163.91 16.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.829 -179.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.504 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 13.5 ttpt -116.47 110.18 18.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.038 -0.528 . . . . 75.05 110.834 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.93 130.33 53.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 74.22 110.93 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.574 HG12 ' N ' ' A' ' 83' ' ' HIS . 25.0 t -92.74 163.52 2.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 74.31 111.129 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.574 ' N ' HG12 ' A' ' 82' ' ' VAL . 31.8 m-70 -102.41 -94.73 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 71.21 110.907 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -176.88 -52.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 74.13 110.812 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.49 -18.38 39.51 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 61.42 110.894 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 129.31 17.1 1.82 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.743 -0.742 . . . . 52.31 112.505 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -112.46 142.38 45.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.876 0.37 . . . . 72.52 110.798 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -140.81 124.17 16.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.154 -0.476 . . . . 74.42 111.138 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 68.5 m -117.55 165.07 13.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.411 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.1 m-85 -112.68 95.16 31.61 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.735 0.778 . . . . 74.23 110.879 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.74 97.77 0.65 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.71 2.273 . . . . 70.43 112.316 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.719 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -72.25 136.49 46.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 64.42 110.887 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.454 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.7 m -133.91 170.23 15.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.91 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.852 ' HB2' HD13 ' A' ' 123' ' ' LEU . 68.2 t80 -113.34 103.72 11.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 65.22 110.9 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 93.5 mt -93.72 120.89 43.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 73.42 111.066 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.1 t80 -103.13 107.73 18.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.856 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.5 t -78.59 92.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 62.13 110.847 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.8 t -123.51 94.02 46.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 50.23 110.867 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.66 -166.13 0.17 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.713 2.275 . . . . 64.01 112.383 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.6 p -113.46 -14.49 10.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 72.24 111.039 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.12 -3.2 73.28 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.734 -0.746 . . . . 52.54 112.469 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.6 p -70.91 164.83 24.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.78 0.324 . . . . 44.53 110.935 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.79 153.23 40.09 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-O 121.594 0.711 . . . . 73.21 110.861 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.27 37.58 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.676 2.251 . . . . 55.21 112.339 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -72.43 -36.76 68.65 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.241 -0.436 . . . . 74.4 110.895 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.464 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -88.86 -57.85 2.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 74.32 110.924 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.24 -34.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 74.33 110.95 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.5 mtm -66.51 -40.25 89.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.233 -0.439 . . . . 55.2 110.869 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' ' O ' ' A' ' 106' ' ' GLN . 43.5 mtp -55.3 -36.0 65.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.212 -0.449 . . . . 65.34 110.81 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.614 ' CE2' HG12 ' A' ' 42' ' ' VAL . 15.6 m-85 -89.2 -41.91 11.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 74.23 110.897 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.402 ' HB1' ' O ' ' A' ' 1' ' ' GLY . . . -56.65 -24.83 51.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.117 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.62 -29.91 6.76 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 34.22 112.45 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -102.4 10.23 39.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.975 0.417 . . . . 61.31 110.92 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HA ' ' CZ ' ' A' ' 74' ' ' PHE . 30.3 ttpt -67.34 -58.56 4.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 64.11 110.86 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -57.93 -37.87 74.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 73.52 110.96 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -56.44 -51.69 67.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.32 110.803 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.892 HD13 HG11 ' A' ' 49' ' ' VAL . 11.5 tp -65.66 -55.97 14.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.883 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.531 HG22 ' CG ' ' A' ' 94' ' ' PHE . 93.2 t -49.71 -53.78 9.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 64.41 111.153 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -51.6 -36.96 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 74.24 110.88 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.949 HG21 HG21 ' A' ' 16' ' ' VAL . 6.0 m -63.85 -44.5 92.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 55.42 111.162 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.08 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -71.15 -19.75 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 75.31 111.185 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.437 ' HB3' ' NH2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER 69.31 31.16 3.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.131 -0.486 . . . . 74.22 110.922 -179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.852 HD13 ' HB2' ' A' ' 94' ' ' PHE . 14.8 mt -71.41 -58.85 3.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.081 -0.509 . . . . 73.03 110.919 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.554 HG22 ' O ' ' A' ' 123' ' ' LEU . 0.5 OUTLIER 80.85 -8.08 1.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.16 -0.473 . . . . 73.43 111.092 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -114.01 93.93 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 74.52 110.874 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.734 HG13 ' HD2' ' A' ' 94' ' ' PHE . 1.9 t -103.23 109.54 27.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 72.03 111.148 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.567 ' CE1' ' HD2' ' A' ' 143' ' ' LYS . 20.7 m-85 -108.33 112.42 24.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.866 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.75 127.93 35.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.185 -0.461 . . . . 63.23 110.803 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.582 HG22 ' HB3' ' A' ' 134' ' ' ASP . 4.6 pt -112.46 114.79 48.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 63.03 111.225 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -57.69 -12.32 2.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 63.51 110.825 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.6 t -173.56 155.1 2.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.066 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 19.9 p -52.73 -41.98 64.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.177 -0.465 . . . . 74.21 111.164 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -33.69 3.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.262 -0.427 . . . . 61.13 110.877 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.582 ' HB3' HG22 ' A' ' 129' ' ' ILE . 0.6 OUTLIER -58.89 -38.32 78.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 71.22 110.829 -179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.639 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -66.75 86.83 0.13 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.234 -0.439 . . . . 72.32 110.889 -179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.3 p -130.16 150.94 51.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 65.21 111.154 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -42.45 -43.04 3.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.287 -0.415 . . . . 75.23 110.913 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.9 m -73.18 -65.76 0.77 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 71.35 111.167 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.544 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 23.0 t90 -39.7 -31.16 0.09 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.102 -0.499 . . . . 73.2 110.901 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.591 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.0 tp -79.29 -63.3 1.45 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.904 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -52.8 -16.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.896 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -71.25 -58.75 3.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 75.55 110.83 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.567 ' HD2' ' CE1' ' A' ' 127' ' ' PHE . 9.8 mmtt -57.44 -39.14 75.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 63.33 110.956 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.489 HD11 HD11 ' A' ' 140' ' ' LEU . 17.6 mt -66.27 -53.17 40.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 72.31 110.912 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -34.57 -56.77 0.53 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.467 . . . . 73.33 111.154 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 51.6 p -79.47 47.52 0.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 75.11 110.919 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -66.97 147.04 49.03 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.684 -0.769 . . . . 63.04 112.537 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 179.94 3.33 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.728 2.286 . . . . 62.45 112.327 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 12.3 t -50.87 154.16 1.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 71.01 110.883 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.2 t 71.57 93.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 73.02 110.813 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 C-N-CA 120.761 -0.733 . . . . 53.42 112.445 -179.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.529 -0.228 . . . . 64.43 112.529 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.3 m -55.45 166.9 0.56 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.845 0.355 . . . . 70.34 110.852 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.4 p -165.79 145.17 6.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 73.31 110.922 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 5' ' ' SER . . . -68.03 149.42 50.21 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.767 -0.73 . . . . 75.52 112.5 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 4' ' ' GLY . 24.5 m -35.61 -47.68 0.48 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 74.44 110.884 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.443 ' O ' ' C ' ' A' ' 7' ' ' GLY . 1.4 t -173.04 -55.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 75.33 110.766 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' A' ' 6' ' ' SER . . . 34.56 -130.13 0.55 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.695 -0.764 . . . . 62.24 112.534 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -152.62 29.92 0.53 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.848 0.356 . . . . 50.0 110.83 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 59.08 46.28 13.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 62.13 110.858 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.7 m -132.74 137.72 46.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 72.23 110.859 -179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.474 HD13 ' CA ' ' A' ' 112' ' ' GLY . 8.7 mt -136.35 -169.29 2.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 61.04 110.952 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.434 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.3 t -95.38 41.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 71.24 111.143 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.434 ' C ' ' O ' ' A' ' 12' ' ' VAL . 97.1 t -34.69 108.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 73.31 111.177 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.4 m -102.11 163.41 12.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 41.43 110.844 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.06 173.91 8.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 65.44 110.967 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.915 HG21 HG21 ' A' ' 120' ' ' THR . 14.5 p -104.23 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.238 -0.437 . . . . 45.02 111.149 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.9 t70 -33.18 140.13 0.23 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.597 0.713 . . . . 72.23 110.945 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.8 -30.58 21.84 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.733 2.289 . . . . 64.41 112.328 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.08 -26.58 61.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.155 -0.475 . . . . 65.52 110.977 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.703 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.4 tt -87.59 -38.54 15.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 63.34 110.891 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -45.73 -45.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 71.24 110.948 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.9 mt-10 -65.61 -46.25 80.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 71.43 110.928 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.4 m -47.2 -45.13 22.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.095 -0.502 . . . . 74.31 111.137 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.107 HD13 ' HB2' ' A' ' 121' ' ' ALA . 25.8 mt -63.46 -51.53 65.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 50.33 110.952 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -58.91 -26.03 63.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.191 -0.459 . . . . 64.51 110.907 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mmtt -86.2 -38.97 17.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 75.21 110.857 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.5 t80 -60.71 -32.71 71.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.436 . . . . 72.25 110.859 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -75.41 -28.76 59.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 74.4 110.871 -179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -128.33 38.99 3.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 75.33 110.873 -179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.479 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -73.08 172.65 10.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 74.24 110.822 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.91 37.12 1.56 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 55.02 110.892 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 27.3 mt-10 -116.59 169.77 9.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 64.11 110.89 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.4 p -142.72 22.29 1.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 75.32 111.124 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -121.27 -174.23 2.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.449 . . . . 65.53 110.877 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -90.82 126.45 36.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 70.34 110.878 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.19 164.23 28.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 64.31 111.064 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.476 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -138.22 149.06 45.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 74.41 111.131 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -132.55 107.69 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 75.42 111.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.8 mt -93.42 116.81 35.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 60.3 111.102 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.758 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.4 OUTLIER -109.56 152.25 25.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 71.3 110.818 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.55 177.23 7.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.146 -0.479 . . . . 75.11 110.876 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.756 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -129.04 112.97 27.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 74.34 111.113 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.401 ' O ' ' N ' ' A' ' 47' ' ' GLN . 57.7 m-20 -77.04 109.98 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 75.23 110.804 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.4 tttt -57.09 -25.44 58.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.242 -0.436 . . . . 70.34 110.888 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.1 -41.95 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.278 -0.419 . . . . 70.14 110.918 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.437 ' O ' ' C ' ' A' ' 47' ' ' GLN . 4.0 mtp180 -106.7 9.06 31.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.2 -0.455 . . . . 75.34 110.906 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 46' ' ' ARG . 3.0 mm-40 34.46 52.09 0.51 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.484 . . . . 73.01 110.904 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.1 ptm -146.61 151.85 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.14 110.855 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.0 t -84.59 112.33 21.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.25 -0.432 . . . . 75.13 111.08 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.2 m -119.29 138.15 50.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 35.05 111.2 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -46.18 140.0 4.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.928 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -108.89 -41.52 4.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.883 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -162.06 165.16 27.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 71.5 110.895 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -149.17 113.51 5.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.866 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 5.2 mt -114.23 132.12 56.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.112 -0.494 . . . . 73.12 110.905 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.414 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 19.2 mp0 -107.79 162.22 14.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.14 110.905 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.414 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 42.59 59.21 2.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 73.55 110.834 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.975 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -128.13 139.51 51.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 71.43 111.14 179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.501 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.26 169.97 17.11 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.669 0.747 . . . . 64.32 110.857 -179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.501 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.8 Cg_endo -69.75 -1.86 9.17 Favored 'Trans proline' 0 N--CA 1.465 -0.189 0 C-N-CA 122.666 2.244 . . . . 74.22 112.373 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.53 ' O ' HD13 ' A' ' 65' ' ' LEU . 5.9 mt-10 -101.12 -25.03 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.44 . . . . 42.31 110.897 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -79.76 -42.99 23.36 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.131 -0.486 . . . . 73.42 110.882 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -53.37 -53.22 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 63.42 110.92 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.03 -38.35 62.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.893 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -68.12 -36.68 80.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 75.21 110.892 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -71.85 -31.99 67.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 72.25 110.853 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.674 HD21 HG21 ' A' ' 75' ' ' VAL . 78.7 mt -68.86 152.7 96.64 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.525 0.679 . . . . 51.23 110.91 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.481 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 52.8 Cg_endo -69.79 -174.81 0.98 Allowed 'Trans proline' 0 C--O 1.231 0.135 0 C-N-CA 122.656 2.237 . . . . 55.25 112.327 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -107.67 -31.59 8.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 70.31 110.908 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mmt-85 -142.34 52.38 1.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 74.35 110.902 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 30.9 mt-30 -142.52 112.42 5.96 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.621 0.724 . . . . 75.34 110.868 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.554 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.79 137.32 35.08 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.607 2.205 . . . . 42.21 112.33 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -169.13 170.14 8.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 75.41 110.858 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -97.81 150.47 21.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 70.13 110.881 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.674 HG21 HD21 ' A' ' 67' ' ' LEU . 21.7 t -153.37 124.3 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 74.32 111.149 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.758 HG23 ' HE1' ' A' ' 40' ' ' MET . 42.3 t -109.68 99.38 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 74.14 111.179 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -91.87 133.97 35.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 75.2 110.891 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -115.17 97.53 6.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.09 -0.505 . . . . 74.45 110.784 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.531 ' CD2' ' N ' ' A' ' 80' ' ' LYS . 69.6 t80 -85.81 168.74 14.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.93 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' N ' ' CD2' ' A' ' 79' ' ' TYR . 20.0 tttt -121.11 105.58 10.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.851 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.57 131.49 47.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.932 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.496 HG12 ' N ' ' A' ' 83' ' ' HIS . 8.3 t -91.98 163.02 2.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.143 -0.48 . . . . 61.21 111.154 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.496 ' N ' HG12 ' A' ' 82' ' ' VAL . 18.4 m-70 -101.4 -93.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 72.02 110.92 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -175.12 -59.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 75.12 110.898 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.98 -14.65 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.23 -0.441 . . . . 72.12 110.864 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.5 12.28 3.45 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.725 -0.75 . . . . 74.32 112.47 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -103.62 142.35 34.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.845 0.355 . . . . 70.04 110.866 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 4.2 p -141.3 131.47 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.458 . . . . 74.03 111.089 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 69.5 m -123.89 167.62 13.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 44.11 110.881 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -116.07 95.23 44.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.607 0.718 . . . . 74.22 110.87 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.76 96.51 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.708 2.272 . . . . 72.24 112.345 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -73.14 123.73 24.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 73.12 110.938 179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.48 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 81.1 m -123.55 155.39 37.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.874 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.658 ' HB2' HD13 ' A' ' 123' ' ' LEU . 70.6 t80 -98.43 104.39 16.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 70.44 110.856 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.9 mt -93.31 110.52 23.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 75.33 111.136 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -91.52 106.94 18.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.839 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.9 t -78.85 93.12 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.89 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.432 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.5 t -127.9 99.38 25.82 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.655 0.74 . . . . 72.34 110.836 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.7 Cg_endo -69.79 -163.19 0.1 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.633 2.222 . . . . 73.42 112.387 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 39.0 t -120.98 -36.02 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.293 -0.412 . . . . 71.12 111.102 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.36 13.14 11.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.839 -0.696 . . . . 60.55 112.475 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 4.4 p -84.58 -179.14 7.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.821 0.343 . . . . 52.31 110.952 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.34 147.26 33.07 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.549 0.69 . . . . 72.41 110.922 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -19.9 35.63 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.705 2.27 . . . . 71.31 112.31 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.18 -35.79 74.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.948 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.48 ' O ' ' N ' ' A' ' 109' ' ' MET . 8.3 mm100 -88.62 -59.67 2.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 74.43 110.927 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.433 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.28 -43.56 0.23 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.41 110.893 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 13.9 mtm -62.86 -45.85 90.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 62.53 110.886 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.48 ' N ' ' O ' ' A' ' 106' ' ' GLN . 84.1 mtp -47.14 -35.0 6.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 50.35 110.929 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.756 ' CE2' HG12 ' A' ' 42' ' ' VAL . 13.2 m-85 -93.94 -36.4 12.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 73.31 110.935 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.87 -24.2 67.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 71.45 111.114 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . 0.474 ' CA ' HD13 ' A' ' 11' ' ' LEU . . . -95.48 -25.31 13.98 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.686 -0.768 . . . . 71.32 112.494 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.8 m -99.59 -1.95 36.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.885 0.374 . . . . 54.14 110.841 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -53.45 -67.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.84 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -47.98 -43.11 29.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 52.22 110.874 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -51.35 70.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.906 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.633 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.2 tm? -63.53 -54.25 39.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.946 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.549 HG22 ' CG ' ' A' ' 94' ' ' PHE . 45.2 t -53.01 -53.98 19.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 73.05 111.186 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -50.37 -37.47 37.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 73.11 110.912 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.915 HG21 HG21 ' A' ' 16' ' ' VAL . 7.0 m -64.41 -43.22 95.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 61.24 111.155 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.107 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.47 -25.67 59.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 51.21 111.176 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 74.72 57.25 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.167 -0.469 . . . . 72.23 110.885 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.658 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.8 mt -110.58 107.89 17.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.168 -0.469 . . . . 75.01 110.849 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.438 HG23 ' HG3' ' A' ' 125' ' ' LYS . 1.2 t -68.04 -23.39 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 74.12 111.206 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.438 ' HG3' HG23 ' A' ' 124' ' ' THR . 17.4 mtmm -103.01 114.76 29.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.52 110.902 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' A' ' 94' ' ' PHE . 22.8 t -125.16 110.02 23.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.327 -0.397 . . . . 62.4 111.104 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 16.6 m-85 -108.66 136.73 47.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 72.42 110.866 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.03 121.45 45.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.93 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.594 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 18.8 pt -102.2 132.95 47.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.118 -0.492 . . . . 64.44 111.123 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 99' ' ' PRO . 0.0 OUTLIER -76.21 -21.85 55.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.903 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.4 t -164.47 146.82 8.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.147 -0.479 . . . . 71.23 111.057 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 135' ' ' LEU . 19.3 p -44.81 -50.11 10.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 55.02 111.091 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -39.23 -32.02 0.09 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.449 . . . . 63.02 110.848 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -62.89 -44.78 95.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 72.24 110.912 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.61 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.2 tp -59.61 92.32 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 74.51 110.909 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -132.8 149.02 52.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.213 -0.449 . . . . 62.25 111.172 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 4.3 tt0 -38.13 -44.27 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 74.51 110.891 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.55 HG22 ' HG3' ' A' ' 142' ' ' GLU . 15.2 m -73.79 -60.23 2.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 62.43 111.136 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 2.6 t90 -46.07 -21.92 0.18 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 61.24 110.867 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.796 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.4 OUTLIER -88.42 -61.61 1.67 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 74.13 110.941 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.796 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.2 mtpm? -58.43 -17.8 23.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.2 -0.454 . . . . 60.13 110.869 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.55 ' HG3' HG22 ' A' ' 138' ' ' THR . 5.6 mt-10 -72.87 -44.91 60.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 61.54 110.821 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.585 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.7 mmtt -65.25 -32.16 73.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.881 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.48 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 9.1 mt -77.88 -49.38 14.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.25 -0.432 . . . . 53.31 110.859 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -44.19 -60.8 1.73 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.224 -0.444 . . . . 73.52 111.137 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 27.3 t -178.55 43.37 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 61.01 110.896 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -68.43 -170.99 6.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.757 -0.735 . . . . 74.15 112.46 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -176.88 1.64 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.721 2.281 . . . . 74.24 112.257 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 27.6 t -171.17 85.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 64.43 110.904 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 2.7 m -135.8 88.28 2.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 61.44 110.822 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 53.24 112.479 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.55 -0.22 . . . . 72.51 112.55 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.78 170.81 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.839 0.352 . . . . 51.31 110.909 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 m 51.45 98.88 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.162 -0.472 . . . . 62.33 110.799 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.08 -67.97 0.52 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.779 -0.724 . . . . 41.43 112.534 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 57.2 m -64.5 148.67 50.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.888 0.375 . . . . 73.32 110.871 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.9 m -133.52 161.54 34.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 72.24 110.914 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.0 -42.91 0.12 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.79 -0.719 . . . . 41.2 112.525 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m 42.16 43.72 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.836 0.35 . . . . 72.11 110.856 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -125.84 -141.03 0.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 52.12 110.898 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.1 m -140.66 143.63 35.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.446 . . . . 74.41 110.869 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.405 HD23 ' SD ' ' A' ' 108' ' ' MET . 9.9 mt -133.08 179.22 6.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.18 -0.463 . . . . 63.15 110.912 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.449 ' O ' ' C ' ' A' ' 13' ' ' VAL . 2.7 t -92.95 38.07 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.183 -0.462 . . . . 63.53 111.175 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.449 ' C ' ' O ' ' A' ' 12' ' ' VAL . 2.3 p -34.0 145.31 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.177 -0.465 . . . . 70.45 111.178 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.4 m -130.28 -177.48 4.34 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 45.43 110.857 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.472 ' HA ' ' CZ ' ' A' ' 116' ' ' ARG . 3.9 pt-20 -108.55 159.66 16.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 71.15 110.906 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.03 HG21 HG21 ' A' ' 120' ' ' THR . 3.3 p -86.98 96.69 5.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.069 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.484 ' OD2' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -35.28 139.9 0.33 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.582 0.706 . . . . 73.44 110.918 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.8 Cg_endo -69.7 -31.37 20.91 Favored 'Trans proline' 0 N--CA 1.465 -0.188 0 C-N-CA 122.721 2.281 . . . . 71.33 112.385 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.484 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -73.65 -26.23 60.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.215 -0.448 . . . . 60.1 110.936 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.735 HD12 ' N ' ' A' ' 51' ' ' LEU . 1.5 tt -89.72 -37.86 14.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.474 . . . . 73.13 110.872 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.2 ttmt -45.31 -43.56 10.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.208 -0.451 . . . . 71.54 110.877 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.7 mt-10 -66.02 -43.96 86.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 74.22 110.901 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.7 m -47.54 -52.34 17.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.192 -0.458 . . . . 72.11 111.158 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.3 mt -58.52 -50.4 73.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 75.31 110.982 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -56.23 -31.93 63.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 72.53 110.869 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.5 mttt -82.18 -36.46 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 64.42 110.875 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.776 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -61.67 -32.81 73.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.55 110.859 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.4 OUTLIER -77.53 -26.02 50.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.826 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.478 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -130.16 39.3 3.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 65.12 110.896 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.11 163.07 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 73.41 110.85 -179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.42 27.18 1.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.41 110.854 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 11.0 mt-10 -103.92 171.44 7.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.274 -0.421 . . . . 61.32 110.867 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.8 p -150.35 32.63 0.65 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 75.54 111.169 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -131.4 -179.39 5.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.167 -0.469 . . . . 62.34 110.857 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -85.63 119.04 25.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 73.54 110.862 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -131.89 164.52 25.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.466 . . . . 63.23 111.094 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -137.79 148.89 45.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.204 -0.453 . . . . 74.11 111.09 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.473 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.2 mt -132.23 107.34 12.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 54.24 111.144 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 6.8 mt -92.75 121.25 43.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 73.35 111.116 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.746 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -114.68 149.1 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 64.33 110.864 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 pttt -128.24 171.67 11.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 75.21 110.952 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.831 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.91 109.16 22.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 72.2 111.117 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.491 ' O ' ' N ' ' A' ' 47' ' ' GLN . 19.9 m-20 -68.35 113.46 5.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.852 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 tmtt? -58.88 -19.55 43.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 75.23 110.876 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.406 ' CG ' ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -80.43 -39.79 27.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 71.15 110.894 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.406 ' HG3' ' CG ' ' A' ' 45' ' ' ASP . 5.4 mtt180 -101.85 -2.64 29.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 72.11 110.885 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 43' ' ' ASP . 1.5 mm-40 42.7 40.62 2.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 62.32 110.897 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.6 ptm -135.45 150.08 49.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 75.44 110.869 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.448 HG11 HD23 ' A' ' 117' ' ' LEU . 21.2 t -81.2 106.13 11.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 74.13 111.068 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.9 m -116.17 138.34 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 52.01 111.161 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.735 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.3 tt -43.34 149.27 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.887 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -118.44 -45.89 2.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 70.41 110.898 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -160.13 164.29 33.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.862 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -147.05 112.65 5.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.868 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.425 HD13 ' HG3' ' A' ' 66' ' ' GLU . 9.6 mt -113.78 129.43 56.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.201 -0.454 . . . . 53.21 110.91 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.443 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 19.1 mp0 -106.6 160.09 15.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.05 110.876 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.443 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.68 54.99 9.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.45 110.886 -179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.963 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.27 137.91 56.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.101 -0.5 . . . . 75.44 111.145 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.477 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -82.71 169.17 18.85 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.651 0.739 . . . . 73.45 110.946 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.8 2.95 3.09 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.657 2.238 . . . . 74.54 112.364 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -103.39 -24.11 13.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.196 -0.456 . . . . 61.23 110.853 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.65 -43.61 14.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 61.53 110.924 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.644 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -52.53 -50.13 63.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.497 . . . . 64.2 110.934 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -38.22 65.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 75.52 110.91 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.3 -41.6 73.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 74.14 110.946 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.3 mm-40 -64.47 -29.27 70.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 72.13 110.894 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.758 HD21 HG21 ' A' ' 75' ' ' VAL . 74.9 mt -76.85 146.7 76.44 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.576 0.703 . . . . 75.31 110.95 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -170.27 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.673 2.249 . . . . 64.04 112.405 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -123.66 -13.57 7.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 74.05 110.926 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.419 ' HG2' ' C ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -139.96 15.87 2.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.136 -0.484 . . . . 54.51 110.85 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.38 103.16 49.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 121.6 0.714 . . . . 73.43 110.885 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.456 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.5 Cg_endo -69.78 137.84 36.37 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.706 2.27 . . . . 61.13 112.338 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.453 ' HA ' ' CD2' ' A' ' 110' ' ' TYR . 0.0 OUTLIER -169.17 171.28 8.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.884 -179.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -97.47 151.47 19.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.962 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.758 HG21 HD21 ' A' ' 67' ' ' LEU . 46.8 t -152.96 129.3 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.167 -0.47 . . . . 64.14 111.106 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.746 HG23 ' CE ' ' A' ' 40' ' ' MET . 69.7 t -111.64 100.77 11.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 73.23 111.143 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.49 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.8 t80 -92.65 132.59 36.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.485 . . . . 72.43 110.936 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -114.7 96.6 5.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.468 . . . . 74.22 110.863 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.546 ' HB2' HD21 ' A' ' 140' ' ' LEU . 64.4 t80 -87.66 166.61 14.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 64.23 110.922 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.538 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.8 ttpp -114.97 112.78 23.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.109 -0.496 . . . . 64.42 110.87 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -107.89 127.22 53.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 73.22 110.94 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 83' ' ' HIS . 80.6 t -92.54 159.58 2.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 60.54 111.131 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.523 ' N ' HG12 ' A' ' 82' ' ' VAL . 26.5 m-70 -98.48 -93.9 0.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.879 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -174.92 -56.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.828 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -56.82 -16.16 6.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 73.15 110.907 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 127.13 13.22 2.97 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.714 -0.755 . . . . 65.12 112.435 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -106.36 136.91 45.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.848 0.356 . . . . 73.23 110.875 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 3.5 p -135.53 127.94 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 53.11 111.137 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 74.3 m -122.32 157.94 30.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 72.2 110.86 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.41 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 2.0 m-85 -107.17 95.17 12.47 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.66 0.743 . . . . 73.42 110.855 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.628 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.76 93.65 0.52 Allowed 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.688 2.258 . . . . 72.23 112.368 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.776 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.35 132.55 44.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 52.42 110.895 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 74.3 m -132.82 167.23 20.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.125 -0.489 . . . . 60.44 110.836 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.612 ' CG ' HG22 ' A' ' 118' ' ' VAL . 81.0 t80 -109.57 105.35 14.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.839 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.49 HD12 ' HB2' ' A' ' 77' ' ' TYR . 97.9 mt -93.44 118.16 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 65.44 111.116 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.574 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.2 t80 -98.29 108.35 21.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 64.41 110.903 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.2 t -78.89 92.15 4.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 62.2 110.886 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.2 t -118.53 94.04 46.72 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.655 0.741 . . . . 52.22 110.86 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 -163.6 0.11 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.675 2.25 . . . . 75.41 112.371 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.9 t -124.61 -30.96 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 73.12 111.109 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.419 ' C ' ' HG2' ' A' ' 70' ' ' ARG . . . -76.01 3.56 50.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.744 -0.741 . . . . 45.13 112.43 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 6.6 p -80.68 -174.47 4.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.89 0.376 . . . . 62.34 110.864 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 150.06 39.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.56 0.695 . . . . 73.2 110.902 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.69 -12.46 33.07 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.667 2.245 . . . . 62.31 112.397 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -77.4 -34.66 54.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 61.11 110.907 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.4 mm100 -91.24 -57.4 2.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 55.3 110.895 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -37.48 -41.37 0.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 72.33 110.887 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.405 ' SD ' HD23 ' A' ' 11' ' ' LEU . 23.6 mtm -64.29 -44.97 89.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 74.33 110.925 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.45 ' N ' ' O ' ' A' ' 106' ' ' GLN . 85.6 mtp -48.68 -36.58 16.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 75.32 110.871 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.831 ' CE2' HG12 ' A' ' 42' ' ' VAL . 30.7 m-85 -90.89 -34.56 15.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.72 -27.72 68.53 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.13 -0.486 . . . . 55.41 111.09 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.48 -24.74 20.55 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.747 -0.739 . . . . 72.11 112.495 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.2 m -97.2 -16.29 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.9 0.381 . . . . 72.31 110.877 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.574 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 25.2 ttpt -45.04 -63.7 0.87 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 73.23 110.857 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -47.19 -46.08 23.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.917 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.472 ' CZ ' ' HA ' ' A' ' 15' ' ' GLU . 11.7 tpt180 -56.58 -54.19 48.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 53.4 110.91 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.671 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.9 tm? -59.88 -57.12 14.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.128 -0.487 . . . . 71.54 110.916 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 94' ' ' PHE . 55.0 t -50.89 -52.78 16.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 74.55 111.167 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -50.75 -37.08 39.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 72.31 110.905 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 1.03 HG21 HG21 ' A' ' 16' ' ' VAL . 12.1 m -64.42 -43.56 93.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.19 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.92 -19.28 60.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.306 -0.407 . . . . 54.25 111.083 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.39 32.44 2.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 62.52 110.85 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.607 HD13 ' HB2' ' A' ' 94' ' ' PHE . 20.9 mt -84.61 88.89 7.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.118 -0.492 . . . . 63.32 110.965 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.3 t -54.56 -27.56 39.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 52.15 111.18 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -101.27 98.82 9.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 71.01 110.904 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.61 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.4 OUTLIER -124.52 114.6 41.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.257 -0.429 . . . . 72.4 111.133 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -104.61 159.96 15.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 72.54 110.826 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -123.6 115.57 21.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.5 . . . . 72.13 110.982 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 11.3 pt -98.49 131.17 46.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 75.31 111.077 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -72.77 -32.08 65.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.08 -0.509 . . . . 72.03 110.86 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.55 146.92 24.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 74.11 111.109 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.4 p -46.07 -43.81 14.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 63.24 111.105 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -41.39 -32.95 0.36 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 71.33 110.849 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' O ' ' N ' ' A' ' 136' ' ' THR . 13.4 t0 -63.74 -48.48 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 52.04 110.888 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.644 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.3 tp -52.08 88.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.26 -0.427 . . . . 61.32 110.85 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 134' ' ' ASP . 1.2 p -129.17 147.55 51.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.181 -0.463 . . . . 45.2 111.182 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -42.05 -44.07 3.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 74.22 110.82 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -70.87 -64.01 0.99 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 72.13 111.162 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . . . . . . . . . 30.2 t90 -40.75 -31.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 73.14 111.013 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.546 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.6 tp -79.72 -65.35 1.01 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 63.05 110.853 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.27 -21.62 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.171 -0.468 . . . . 72.34 110.903 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -66.18 -61.14 2.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.236 -0.438 . . . . 74.43 110.896 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -53.21 -43.6 67.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 64.11 110.919 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.628 HD13 ' HG2' ' A' ' 91' ' ' PRO . 14.4 mt -64.89 -46.15 82.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.871 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.39 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.21 111.071 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.2 30.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 74.4 110.912 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.75 149.47 13.75 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.739 -0.743 . . . . 63.05 112.407 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 6.62 1.25 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.272 . . . . 73.33 112.32 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 42.2 t -116.17 -61.47 1.73 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 72.0 110.799 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 9.0 t -83.4 44.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 42.43 110.88 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 C-N-CA 120.76 -0.734 . . . . 74.42 112.439 -179.928 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.512 -0.235 . . . . 71.4 112.512 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 m 38.79 80.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.816 0.341 . . . . 73.35 110.903 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.22 -45.07 88.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 71.13 110.838 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.48 105.16 0.36 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.729 -0.748 . . . . 32.12 112.426 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.67 -62.66 1.65 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.877 0.37 . . . . 60.1 110.829 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 52.75 177.92 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 73.02 110.895 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -40.64 103.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.736 -0.745 . . . . 45.24 112.476 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.6 m -100.65 83.48 2.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.823 0.344 . . . . 63.42 110.853 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -175.53 83.78 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 75.14 110.909 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 57.1 159.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.177 -0.465 . . . . 70.15 110.834 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -141.05 -176.11 4.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 70.51 110.889 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.485 HG12 ' O ' ' A' ' 12' ' ' VAL . 9.2 t -90.59 37.95 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.151 -0.477 . . . . 74.41 111.184 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.419 ' C ' ' O ' ' A' ' 12' ' ' VAL . 93.5 t -36.14 95.41 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.132 -0.485 . . . . 52.31 111.174 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.444 ' N ' ' O ' ' A' ' 12' ' ' VAL . 62.7 m -88.56 -176.23 5.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.218 -0.446 . . . . 74.52 110.887 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -112.36 162.06 15.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 74.35 110.822 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.06 HG21 HG21 ' A' ' 120' ' ' THR . 2.6 p -90.35 98.8 8.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 72.45 111.136 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.497 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.5 t70 -34.5 140.07 0.29 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.685 0.755 . . . . 74.42 110.852 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.1 Cg_endo -69.84 -30.39 21.99 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.663 2.242 . . . . 64.52 112.278 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.497 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.1 OUTLIER -73.32 -26.26 60.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.315 -0.402 . . . . 75.23 110.885 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.493 ' O ' HD23 ' A' ' 20' ' ' LEU . 2.6 tt -87.19 -46.6 9.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.2 -0.455 . . . . 51.55 110.896 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.6 ttmt -35.5 -47.07 0.43 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.157 -0.474 . . . . 63.12 110.907 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.48 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 6.0 mt-10 -64.13 -46.27 84.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.22 -0.446 . . . . 75.21 110.935 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 20' ' ' LEU . 7.2 m -46.26 -48.06 18.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 74.54 111.067 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.98 HD13 ' HB2' ' A' ' 121' ' ' ALA . 32.6 mt -63.31 -52.22 62.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.206 -0.452 . . . . 73.45 110.891 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.8 ttm-85 -56.63 -32.07 64.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.296 -0.411 . . . . 61.11 110.827 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.7 mmtt -78.82 -43.45 25.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.252 -0.431 . . . . 72.23 110.844 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.811 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.7 t80 -53.96 -38.72 65.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 72.44 110.902 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.589 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 2.4 mtm-85 -69.74 -38.35 76.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 74.35 110.905 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -117.46 39.68 3.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.854 -179.915 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -73.67 161.67 30.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 43.04 110.926 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -86.77 31.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.172 -0.467 . . . . 64.41 110.973 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 68.4 mm-40 -112.52 174.56 5.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.186 -0.461 . . . . 70.03 110.91 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 75.2 p -147.99 32.88 0.83 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 64.14 111.122 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.538 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.81 178.49 7.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.289 -0.414 . . . . 75.41 110.901 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.538 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 88.4 m-20 -78.61 143.96 35.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 62.15 110.957 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.432 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -156.67 154.91 30.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 70.31 111.072 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.657 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -128.95 153.16 47.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 63.23 111.056 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.506 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -135.96 111.43 11.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 61.23 111.129 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.45 ' CG2' ' HD3' ' A' ' 73' ' ' ARG . 3.3 mt -94.69 109.37 22.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 64.23 111.136 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.439 ' CE ' HG23 ' A' ' 76' ' ' VAL . 4.1 mtm -108.02 149.34 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.106 -0.497 . . . . 62.35 110.898 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.91 176.53 6.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 62.02 110.881 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.88 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.3 OUTLIER -125.66 107.05 17.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.215 -0.448 . . . . 63.25 111.137 179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.425 ' O ' ' N ' ' A' ' 47' ' ' GLN . 5.3 m-20 -66.22 118.93 10.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.155 -0.475 . . . . 71.23 110.856 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -67.53 -23.31 65.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 63.4 110.921 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -72.82 -36.47 67.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.183 -0.462 . . . . 70.33 110.861 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.7 mtp180 -109.8 2.16 19.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.426 . . . . 75.01 110.898 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 40.73 50.13 2.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.891 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.6 ptm -144.98 154.38 42.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 74.02 110.845 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.414 HG11 ' HG ' ' A' ' 117' ' ' LEU . 3.4 t -86.03 115.72 27.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 73.44 111.129 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.425 HG12 ' CG ' ' A' ' 17' ' ' ASP . 32.0 m -126.1 137.16 58.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.15 111.125 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 54' ' ' GLU . 1.2 tp -48.09 148.76 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 52.33 110.89 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.448 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 2.8 tp10 -120.67 -49.91 2.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 65.12 110.869 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -153.02 167.65 28.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 54.33 110.841 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.698 ' HG3' HD11 ' A' ' 51' ' ' LEU . 3.2 mt-10 -152.28 119.42 5.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 64.14 110.838 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.444 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -116.15 131.84 56.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.07 -0.514 . . . . 74.45 110.893 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 16.9 mp0 -111.18 161.63 15.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.871 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.42 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 51.25 55.64 9.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.901 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.981 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -132.09 139.4 50.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.211 -0.45 . . . . 70.13 111.111 179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.49 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.38 169.22 19.84 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.699 0.762 . . . . 75.54 110.869 -179.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.685 ' O ' HD22 ' A' ' 135' ' ' LEU . 53.9 Cg_endo -69.77 3.21 2.91 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.711 2.274 . . . . 72.53 112.354 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -107.71 -19.04 13.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.278 -0.419 . . . . 74.32 110.933 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.42 -39.16 16.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 63.12 110.887 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.657 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -56.48 -60.29 3.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.149 -0.478 . . . . 73.5 110.997 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.523 ' N ' HD13 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -36.67 -45.15 0.5 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 74.41 110.885 179.8 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 4.6 mp -63.26 -40.8 98.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 74.34 110.893 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 63' ' ' LEU . 43.9 mm-40 -58.69 -35.0 71.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.42 110.904 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 1.043 HD21 HG21 ' A' ' 75' ' ' VAL . 83.8 mt -67.46 153.08 95.53 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.605 0.717 . . . . 73.32 110.915 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.431 ' CB ' ' HB2' ' A' ' 71' ' ' GLN . 53.5 Cg_endo -69.74 -164.67 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.639 2.226 . . . . 64.33 112.371 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.95 -20.56 10.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 74.04 110.914 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 1.8 ppt_? -155.86 42.94 0.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 72.33 110.82 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.431 ' HB2' ' CB ' ' A' ' 68' ' ' PRO . 5.6 mt-30 -133.06 110.83 13.0 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.622 0.725 . . . . 75.22 110.91 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.2 Cg_endo -69.68 129.4 17.61 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.673 2.249 . . . . 74.52 112.369 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.45 ' HD3' ' CG2' ' A' ' 39' ' ' ILE . 13.9 ptp180 -159.78 167.65 27.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 62.53 110.857 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -95.9 141.06 29.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.33 110.92 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 1.043 HG21 HD21 ' A' ' 67' ' ' LEU . 98.5 t -141.94 119.06 7.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 45.4 111.187 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 76' ' ' VAL . 8.0 t -106.4 99.84 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 61.31 111.155 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -95.52 138.8 32.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.913 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 t -116.33 96.61 5.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.495 . . . . 73.53 110.799 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.597 ' CE2' ' O ' ' A' ' 80' ' ' LYS . 53.5 t80 -85.52 165.17 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.903 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.597 ' O ' ' CE2' ' A' ' 79' ' ' TYR . 33.0 ttpt -115.11 112.57 22.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.073 -0.512 . . . . 72.21 110.892 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.6 OUTLIER -106.83 134.87 49.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 73.22 110.895 -179.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 38.0 t -95.84 153.17 3.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.133 -0.485 . . . . 72.31 111.147 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -92.33 -92.98 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.28 -0.418 . . . . 62.15 110.841 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -179.63 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.181 -0.463 . . . . 75.43 110.917 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -11.43 38.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.474 . . . . 51.45 110.893 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.01 11.53 5.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.78 -0.724 . . . . 60.25 112.496 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 20.0 mmt85 -107.02 141.93 37.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.878 0.37 . . . . 71.14 110.883 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 81' ' ' TYR . 4.1 p -140.29 123.07 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.33 111.149 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 57.9 m -117.52 162.21 18.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.14 110.866 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.508 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.1 m-85 -109.06 94.69 15.54 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.71 0.767 . . . . 72.34 110.928 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.454 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.7 Cg_endo -69.8 96.75 0.61 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.666 2.244 . . . . 72.3 112.302 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.811 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.11 130.98 42.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 75.05 110.925 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.443 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.1 m -129.28 165.78 20.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.234 -0.439 . . . . 61.33 110.936 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.72 ' CE1' HD12 ' A' ' 117' ' ' LEU . 84.2 t80 -108.0 102.81 11.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 74.45 110.857 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.2 mt -93.14 105.94 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.145 -0.48 . . . . 62.44 111.084 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.441 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.5 t80 -87.92 109.81 20.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 61.04 110.929 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.6 t -78.72 102.42 8.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 72.03 110.901 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.413 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 1.1 t -130.22 94.0 31.64 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.706 0.765 . . . . 62.25 110.875 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.416 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.3 Cg_endo -69.7 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.625 2.217 . . . . 64.45 112.414 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.5 t -121.19 -30.4 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.285 -0.416 . . . . 53.35 111.154 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.02 10.01 29.0 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.725 -0.75 . . . . 74.43 112.495 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.3 p -86.34 -179.66 6.72 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.862 0.363 . . . . 60.34 110.851 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.3 148.52 35.81 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.553 0.692 . . . . 71.42 110.897 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.79 31.58 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.608 2.206 . . . . 64.24 112.355 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -76.58 -36.39 57.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 71.21 110.84 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.504 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.7 mm100 -91.02 -57.99 2.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.48 . . . . 74.53 110.864 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.95 -39.83 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 73.15 110.913 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.0 mtm -63.74 -42.71 97.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.25 -0.432 . . . . 75.24 110.868 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.504 ' N ' ' O ' ' A' ' 106' ' ' GLN . 0.1 OUTLIER -55.12 -30.12 59.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 71.53 110.875 179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.88 ' CE2' HG12 ' A' ' 42' ' ' VAL . 45.7 m-85 -95.51 -33.6 12.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.174 -0.466 . . . . 73.12 110.879 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.39 -28.48 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.086 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.33 -30.4 10.92 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 64.2 112.506 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.9 m -92.27 -5.63 51.97 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 55.03 110.912 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.441 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 32.3 ttpt -51.03 -67.74 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.08 -0.509 . . . . 72.14 110.91 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -44.96 -39.5 5.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 73.23 110.895 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.7 tpp180 -63.38 -52.21 62.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 73.23 110.897 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.72 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.2 tm? -63.08 -52.77 61.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.435 . . . . 70.2 110.89 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.688 HG22 ' CD2' ' A' ' 94' ' ' PHE . 79.0 t -54.27 -51.23 50.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 73.33 111.137 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -52.51 -38.69 60.14 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.174 -0.466 . . . . 61.52 110.886 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 1.06 HG21 HG21 ' A' ' 16' ' ' VAL . 6.3 m -62.83 -43.16 99.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 63.11 111.134 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.98 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -77.37 -11.68 59.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.141 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 62.13 41.53 10.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 73.1 110.892 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.575 HD13 ' HB2' ' A' ' 94' ' ' PHE . 11.9 mt -96.9 84.12 3.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.2 -0.454 . . . . 65.23 110.858 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 8.6 m -48.43 -37.78 18.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 73.21 111.115 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -91.77 103.13 15.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.304 -0.407 . . . . 71.0 110.886 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.638 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -124.78 114.69 41.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 72.43 111.109 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 4.2 m-85 -108.42 163.31 13.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 71.35 110.847 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -127.67 136.93 52.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.492 . . . . 64.11 110.899 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.592 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 5.6 pt -114.95 124.5 71.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 71.13 111.161 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.96 -11.42 60.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 75.34 110.925 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.596 HG23 ' OD1' ' A' ' 134' ' ' ASP . 1.5 t -169.83 150.17 3.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.183 -0.462 . . . . 60.45 111.126 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.405 ' O ' ' CD ' ' A' ' 64' ' ' LYS . 38.9 p -57.02 -33.34 67.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 74.04 111.097 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.44 -14.03 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.306 -0.406 . . . . 53.23 110.894 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.596 ' OD1' HG23 ' A' ' 131' ' ' THR . 14.1 m-20 -82.23 -36.5 27.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 75.41 110.873 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.685 HD22 ' O ' ' A' ' 60' ' ' PRO . 1.0 OUTLIER -59.4 81.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 72.25 110.964 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.505 ' O ' ' N ' ' A' ' 138' ' ' THR . 26.0 p -125.3 145.02 50.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 74.05 111.131 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.472 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -38.6 -25.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 62.42 110.924 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.505 ' N ' ' O ' ' A' ' 136' ' ' THR . 17.2 m -84.01 -72.47 0.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 71.3 111.149 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.592 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 4.8 t90 -39.59 -28.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.285 -0.416 . . . . 74.32 110.998 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.767 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -79.4 -60.16 2.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.924 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.767 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.5 OUTLIER -56.0 -44.2 78.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 62.02 110.924 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -48.81 -47.04 42.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.856 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 19.5 mmtt -63.54 -42.67 98.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.178 -0.464 . . . . 64.15 110.864 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.454 HD13 ' HG2' ' A' ' 91' ' ' PRO . 39.0 mt -63.7 -44.01 94.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 61.52 110.933 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -53.87 -60.71 2.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 55.43 111.12 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.84 44.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 64.04 110.821 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -45.37 151.77 0.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.718 -0.753 . . . . 53.02 112.528 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -174.11 0.85 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.678 2.252 . . . . 72.02 112.369 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 13.4 m -120.37 -62.56 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.293 -0.412 . . . . 64.34 110.859 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -128.59 103.0 6.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 75.23 110.871 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.716 -0.754 . . . . 44.53 112.516 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.464 -0.254 . . . . 73.3 112.464 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 113.8 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.858 0.361 . . . . 71.1 110.888 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.9 t -170.84 42.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.116 -0.493 . . . . 34.32 110.81 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.81 -165.26 32.93 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.698 -0.763 . . . . 43.2 112.491 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.8 t -157.97 139.35 13.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.919 0.39 . . . . 75.54 110.853 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 95.0 p -133.78 165.79 24.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.099 -0.501 . . . . 74.11 110.861 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -45.42 -82.18 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.701 -0.761 . . . . 53.14 112.573 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 88.7 p -66.92 149.93 49.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.93 0.395 . . . . 73.11 110.866 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.46 83.36 2.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.82 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 94.0 p -118.14 148.05 42.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 75.42 110.872 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.6 mt -136.94 176.99 8.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 74.35 110.96 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.628 HG22 ' O ' ' A' ' 12' ' ' VAL . 13.7 p -92.96 43.11 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.45 . . . . 75.33 111.071 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.0 p -37.64 152.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.245 -0.434 . . . . 51.2 111.125 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 97.8 m -130.61 -176.4 3.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.922 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -108.54 154.26 22.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.9 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.738 HG13 ' O ' ' A' ' 16' ' ' VAL . 14.6 p -82.71 98.84 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 53.3 111.162 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.488 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 14.8 t70 -33.73 140.69 0.24 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.579 0.704 . . . . 73.32 110.82 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.6 Cg_endo -69.88 -34.31 14.43 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.694 2.263 . . . . 72.32 112.299 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.488 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -70.44 -25.49 63.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 74.23 110.892 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' A' ' 40' ' ' MET . 1.2 tt -89.79 -41.47 11.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 70.3 110.95 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.479 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 11.8 ttmt -41.33 -49.07 3.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.233 -0.439 . . . . 74.12 110.877 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.453 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 8.3 mt-10 -62.21 -46.18 90.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.46 . . . . 63.43 110.839 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.7 m -48.21 -45.65 34.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.162 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.999 HD13 ' HB2' ' A' ' 121' ' ' ALA . 24.1 mt -63.64 -52.49 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 63.51 110.872 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.581 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.9 OUTLIER -56.94 -32.47 66.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.277 -0.42 . . . . 70.4 110.898 179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ARG . 1.4 mmtt -79.63 -40.6 28.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.174 -0.466 . . . . 73.35 110.853 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.772 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.6 t80 -58.54 -35.39 72.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.273 -0.421 . . . . 72.23 110.889 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.6 OUTLIER -75.24 -28.13 59.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.092 -0.504 . . . . 73.54 110.9 -179.916 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.581 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -128.03 40.3 3.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 75.04 110.916 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -77.78 169.74 17.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.153 -0.476 . . . . 73.34 110.83 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.63 36.68 1.6 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 60.35 110.886 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.469 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 6.3 mm-40 -106.8 -177.9 3.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 74.5 110.832 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.4 p -156.16 21.6 0.37 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 61.22 111.223 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -126.72 177.27 6.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 74.1 110.875 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -83.39 130.08 35.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 61.33 110.902 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -141.22 159.66 41.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 60.34 111.117 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.589 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -131.26 152.14 50.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 72.22 111.105 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.0 mt -136.0 106.16 5.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 62.32 111.101 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.43 119.51 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 65.04 111.097 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.776 ' CE ' HG23 ' A' ' 76' ' ' VAL . 1.3 mtm -115.24 144.73 43.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 75.33 110.86 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.39 176.98 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 73.55 110.949 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.76 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.08 115.35 38.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 71.22 111.04 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.446 ' O ' ' N ' ' A' ' 47' ' ' GLN . 10.7 m-20 -77.57 112.07 13.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 64.04 110.9 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.68 -24.55 57.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.859 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.26 -40.68 74.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 64.23 110.838 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.425 ' O ' ' C ' ' A' ' 47' ' ' GLN . 12.5 mtp180 -108.24 6.25 26.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.192 -0.458 . . . . 65.52 110.851 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.0 mm-40 36.22 50.97 0.77 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.468 . . . . 71.52 110.816 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.4 ptm -143.41 146.56 33.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 72.21 110.86 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.418 HG11 HD13 ' A' ' 117' ' ' LEU . 47.4 t -81.09 105.62 11.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 54.04 111.14 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.401 HG12 ' OD2' ' A' ' 17' ' ' ASP . 33.7 m -112.62 142.79 23.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.269 -0.423 . . . . 71.33 111.181 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.8 tt -49.62 143.8 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.956 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -111.2 -40.91 4.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.867 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -167.85 164.57 14.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 72.54 110.875 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -146.35 110.65 5.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.261 -0.427 . . . . 64.52 110.926 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.472 HD13 ' HG3' ' A' ' 66' ' ' GLU . 10.1 mt -109.22 128.3 54.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 70.35 110.894 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.451 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 11.9 mp0 -107.51 161.8 14.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 63.4 110.917 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.451 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 46.64 55.66 7.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 71.0 110.936 -179.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.951 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.58 140.27 49.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.158 -0.474 . . . . 70.41 111.156 179.936 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.484 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -83.73 169.29 17.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.692 0.758 . . . . 74.42 110.84 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.5 Cg_endo -69.64 3.0 2.97 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.771 2.314 . . . . 75.43 112.343 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.09 -24.5 13.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.86 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.58 -41.0 16.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.901 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.633 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -55.37 -53.85 50.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.164 -0.471 . . . . 74.54 110.897 179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -48.98 -33.17 10.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.117 -0.492 . . . . 70.01 110.933 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -74.24 -38.86 63.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.253 -0.43 . . . . 65.42 110.889 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.472 ' HG3' HD13 ' A' ' 55' ' ' LEU . 7.6 mm-40 -67.8 -27.23 66.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 71.35 110.882 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.413 ' CD2' HG21 ' A' ' 75' ' ' VAL . 36.8 mt -82.22 140.84 45.83 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.623 0.725 . . . . 74.21 110.926 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.479 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.4 Cg_endo -69.78 -170.52 0.4 Allowed 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.721 2.281 . . . . 73.42 112.333 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.416 ' O ' ' HB2' ' A' ' 99' ' ' PRO . 9.8 pt-20 -136.8 1.84 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.233 -0.44 . . . . 52.22 110.805 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -132.66 -12.92 2.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.898 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 68' ' ' PRO . 36.7 mt-30 -116.19 117.21 39.2 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.594 0.712 . . . . 64.12 110.991 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.424 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.77 158.44 56.94 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.671 2.247 . . . . 71.23 112.321 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.479 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER 177.07 170.46 0.53 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 74.41 110.874 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.559 ' CD2' HD22 ' A' ' 117' ' ' LEU . 28.8 m-85 -97.94 155.07 17.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 74.4 110.856 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.413 HG21 ' CD2' ' A' ' 67' ' ' LEU . 20.5 t -153.01 115.11 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.211 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.776 HG23 ' CE ' ' A' ' 40' ' ' MET . 67.9 t -101.77 97.22 5.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 74.15 111.173 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -93.56 133.58 36.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 73.1 110.89 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -112.59 97.54 6.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.891 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.587 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -84.32 167.44 16.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.02 110.943 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.517 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 3.1 ttpm? -118.84 106.82 12.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 71.11 110.859 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.53 130.67 47.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 72.21 110.92 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.452 HG13 ' HB ' ' A' ' 88' ' ' VAL . 12.6 t -96.77 154.42 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.484 . . . . 62.21 111.195 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -91.1 -88.43 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 75.5 110.849 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.25 -42.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 71.42 110.89 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -13.95 62.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.893 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.71 13.49 3.05 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.759 -0.734 . . . . 74.42 112.456 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 8.5 mmt180 -113.31 136.5 52.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.851 0.358 . . . . 55.42 110.842 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.452 ' HB ' HG13 ' A' ' 82' ' ' VAL . 3.4 p -137.79 126.55 33.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 74.55 111.127 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 23.4 m -120.12 165.16 15.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.931 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.496 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.0 OUTLIER -111.85 95.22 27.71 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.744 0.783 . . . . 72.51 110.887 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.534 ' HG2' HD13 ' A' ' 144' ' ' LEU . 53.2 Cg_endo -69.8 96.91 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.68 2.253 . . . . 74.25 112.327 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.772 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.01 134.63 46.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 70.12 110.955 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.5 ' SG ' HD21 ' A' ' 144' ' ' LEU . 92.9 m -133.52 161.07 35.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.192 -0.458 . . . . 63.52 110.895 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 118' ' ' VAL . 75.7 t80 -104.71 105.12 15.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.252 -0.431 . . . . 73.44 110.921 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 97.4 mt -93.26 122.4 44.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 71.42 111.156 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.412 ' O ' ' CG1' ' A' ' 129' ' ' ILE . 0.4 OUTLIER -99.87 106.66 18.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.918 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 25.8 t -78.73 90.55 4.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.502 . . . . 71.23 110.835 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -116.58 98.56 51.85 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.718 0.77 . . . . 74.0 110.84 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.416 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 53.4 Cg_endo -69.69 -163.55 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.724 2.283 . . . . 72.14 112.351 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.3 t -123.11 -25.66 2.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.244 -0.434 . . . . 72.32 111.103 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.48 8.44 68.39 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.704 -0.76 . . . . 71.32 112.5 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 26.2 p -83.38 175.07 10.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 72.15 110.932 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.07 153.27 38.45 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.576 0.703 . . . . 75.13 110.87 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 -11.97 31.85 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.601 2.201 . . . . 62.2 112.338 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -76.16 -35.0 59.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.287 -0.415 . . . . 75.53 110.839 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.483 ' O ' ' N ' ' A' ' 109' ' ' MET . 9.2 mm100 -89.37 -59.83 2.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 61.55 110.913 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.423 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.67 -42.78 0.26 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 72.34 110.942 -179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 15.1 mtm -62.01 -45.47 93.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 70.22 110.902 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.58 ' HG2' HG11 ' A' ' 12' ' ' VAL . 51.2 mtp -50.69 -41.32 55.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 71.41 110.937 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.76 ' CE2' HG12 ' A' ' 42' ' ' VAL . 32.9 m-85 -83.46 -34.06 25.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 74.23 110.985 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.55 -24.52 63.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.076 -0.511 . . . . 61.41 111.049 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.42 -22.96 20.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.774 -0.727 . . . . 75.13 112.474 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.6 m -102.14 -7.65 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.919 0.39 . . . . 54.53 110.818 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -53.62 -66.78 0.33 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.159 -0.473 . . . . 71.03 110.969 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -44.95 -40.45 6.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.211 -0.45 . . . . 73.35 110.873 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -61.32 -52.13 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.3 110.875 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.559 HD22 ' CD2' ' A' ' 74' ' ' PHE . 9.8 tp -65.35 -55.6 17.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 74.55 110.961 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.439 HG22 ' CD1' ' A' ' 94' ' ' PHE . 75.4 t -49.78 -57.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.23 -0.441 . . . . 73.51 111.16 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -49.79 -33.83 17.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.883 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.718 HG21 HG21 ' A' ' 16' ' ' VAL . 22.2 m -66.27 -44.55 83.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.249 -0.432 . . . . 71.31 111.159 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.999 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.36 -26.21 63.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 52.55 111.123 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.417 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 0.0 OUTLIER 77.85 33.36 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.441 . . . . 73.42 110.933 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 14.0 mt -86.51 93.39 9.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 74.22 110.913 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 23.3 m -51.29 -42.8 61.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.12 111.19 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -85.11 119.47 25.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 73.14 110.888 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -128.75 112.15 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 64.4 111.147 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -110.96 159.28 17.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.892 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -128.65 152.08 48.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.52 110.853 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.412 ' CG1' ' O ' ' A' ' 96' ' ' PHE . 14.3 pt -138.13 127.93 34.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 75.31 111.118 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.3 tpp85 -78.09 -9.06 58.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 73.44 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -172.14 142.61 1.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 73.22 111.108 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 134' ' ' ASP . 67.2 p -44.38 -47.83 9.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 63.23 111.184 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.424 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.34 -31.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.906 179.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.461 ' N ' ' O ' ' A' ' 132' ' ' THR . 1.3 t0 -64.99 -50.36 66.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 73.44 110.855 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.633 HD21 ' HB3' ' A' ' 63' ' ' LEU . 7.3 tp -53.35 86.18 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 74.41 110.934 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -124.85 150.16 46.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 64.22 111.11 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -43.01 -43.4 4.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 62.14 110.899 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.469 ' O ' ' N ' ' A' ' 140' ' ' LEU . 8.2 m -72.87 -65.9 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 74.12 111.183 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.427 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 22.7 t90 -40.16 -25.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.945 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 79' ' ' TYR . 7.3 tp -83.23 -61.55 1.82 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.175 -0.466 . . . . 64.13 110.927 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.6 mtpm? -56.68 -19.06 14.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 71.42 110.886 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.4 -54.0 29.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 74.52 110.915 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -62.26 -44.47 96.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.09 -0.504 . . . . 72.52 110.875 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' A' ' 91' ' ' PRO . 26.5 mt -62.11 -43.71 98.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 64.33 110.904 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -37.92 -67.81 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 61.13 111.089 179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.53 42.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.205 -0.452 . . . . 71.12 110.82 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -58.66 170.62 4.82 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.702 -0.761 . . . . 61.42 112.515 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 -176.58 1.54 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.655 2.237 . . . . 74.22 112.289 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -125.11 -52.14 1.65 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 51.32 110.869 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -106.6 150.78 25.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 75.12 110.884 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.852 -0.69 . . . . 44.33 112.429 -179.981 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 112.489 -0.244 . . . . 73.4 112.489 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 53.9 170.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.941 0.401 . . . . 73.32 110.832 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.9 t -164.81 170.52 15.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 73.32 110.809 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.09 -96.1 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 74.31 112.47 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.8 t -155.62 85.04 1.04 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.927 0.394 . . . . 64.53 110.879 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 178.09 169.73 0.74 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.048 -0.524 . . . . 53.02 110.897 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 98.33 -92.39 1.23 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.749 -0.739 . . . . 52.45 112.554 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -162.51 -45.6 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.882 0.372 . . . . 65.25 110.864 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 39.94 84.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.492 . . . . 73.22 110.896 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.5 m -91.66 123.13 34.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 75.52 110.832 -179.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.6 mt -133.83 -167.29 1.92 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.899 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.8 t -98.12 50.19 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 72.34 111.178 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.0 t -42.08 112.76 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.455 . . . . 41.42 111.159 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 67.9 m -102.97 169.86 8.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.213 -0.448 . . . . 74.14 110.887 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.44 174.15 7.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 75.31 110.889 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.803 HG21 HG21 ' A' ' 120' ' ' THR . 7.9 p -103.86 98.13 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 63.23 111.143 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.456 ' C ' ' O ' ' A' ' 16' ' ' VAL . 13.8 t70 -33.45 140.39 0.24 Allowed Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.618 0.723 . . . . 73.13 110.829 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.5 Cg_endo -69.73 -35.05 13.46 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.706 2.27 . . . . 73.11 112.321 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -69.13 -25.78 64.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 44.53 110.89 -179.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.48 -38.85 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 74.51 110.907 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.478 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.0 ttmt -45.61 -49.16 14.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 62.44 110.875 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.5 mt-10 -62.19 -45.9 91.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.246 -0.434 . . . . 73.03 110.869 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 3.2 m -47.6 -45.31 27.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 71.41 111.117 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.085 HD13 ' HB2' ' A' ' 121' ' ' ALA . 22.8 mt -64.06 -52.22 60.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 63.34 110.871 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.3 ttm-85 -57.81 -32.77 67.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 71.41 110.864 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.447 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 8.1 mmtt -78.61 -40.73 33.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 53.51 110.904 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.8 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.4 t80 -56.99 -38.85 73.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.436 . . . . 74.5 110.869 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.7 mtm-85 -71.58 -33.26 68.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 73.35 110.829 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.522 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -119.45 39.4 3.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.22 110.918 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.443 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -76.05 155.79 34.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.23 110.845 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.46 30.58 0.62 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.182 -0.463 . . . . 72.35 110.884 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 28.4 mt-10 -108.88 172.55 6.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 65.31 110.911 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.7 p -146.46 33.72 0.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 64.14 111.11 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.507 ' OD1' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -135.27 173.55 11.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.1 110.9 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.507 ' N ' ' OD1' ' A' ' 34' ' ' ASN . 81.9 m-20 -75.64 144.19 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 64.42 110.886 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.59 161.35 40.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.238 -0.437 . . . . 71.03 111.125 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.554 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -135.91 151.32 49.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 75.43 111.017 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.831 HG23 ' CG ' ' A' ' 54' ' ' GLU . 9.5 mt -135.86 109.19 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 72.35 111.13 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.42 HG12 HG22 ' A' ' 75' ' ' VAL . 3.4 mt -92.18 116.15 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 74.41 111.117 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.678 ' HE1' HG23 ' A' ' 76' ' ' VAL . 2.1 mtm -113.21 145.78 40.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.43 110.929 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.484 ' CE ' ' OE2' ' A' ' 52' ' ' GLU . 9.5 pttt -127.31 177.77 6.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.295 -0.412 . . . . 73.21 110.881 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.674 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -122.75 117.68 52.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 74.34 111.168 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.64 119.21 21.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.918 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 tttt -68.47 -24.47 64.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.272 -0.422 . . . . 61.2 110.964 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -35.49 71.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 65.22 110.816 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 47' ' ' GLN . 8.4 mtp180 -114.27 8.48 16.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 71.43 110.94 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.431 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.6 mm-40 35.32 54.14 0.78 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.144 -0.48 . . . . 73.33 110.928 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.4 ptm -148.2 151.87 36.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.189 -0.46 . . . . 73.32 110.931 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.847 HG11 HD13 ' A' ' 117' ' ' LEU . 47.7 t -82.74 110.26 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 63.02 111.178 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 m -117.58 141.48 36.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 65.31 111.163 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 tt -50.42 135.1 22.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.215 -0.448 . . . . 62.34 110.919 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' OE2' ' CE ' ' A' ' 41' ' ' LYS . 2.1 tt0 -102.28 -39.28 7.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.459 . . . . 64.22 110.915 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.413 ' CG ' ' O ' ' A' ' 52' ' ' GLU . 20.2 m-20 -169.28 161.34 10.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 60.22 110.856 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.831 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.4 mt-10 -146.62 115.86 7.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 74.35 110.847 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.559 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.4 mt -118.64 143.02 47.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.463 . . . . 65.55 110.905 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.495 ' O ' HG22 ' A' ' 58' ' ' ILE . 15.5 mp0 -118.59 168.69 10.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.157 -0.474 . . . . 75.0 110.893 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 44.98 52.96 7.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.927 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.984 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.36 140.16 49.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.2 111.112 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.48 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -82.22 169.15 19.36 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.645 0.736 . . . . 72.03 110.872 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 52.9 Cg_endo -69.79 3.07 3.0 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.708 2.272 . . . . 71.54 112.355 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.685 ' O ' HD13 ' A' ' 65' ' ' LEU . 2.9 mt-10 -102.18 -27.14 13.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 74.2 110.875 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.3 -42.27 19.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.32 110.894 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -52.69 -51.1 61.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 72.53 110.869 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.515 ' HG2' HD12 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -55.18 -28.86 55.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.31 110.886 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 61' ' ' GLU . 4.2 mp -80.34 -31.7 37.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.26 -0.427 . . . . 74.3 110.944 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.559 ' HG3' HD13 ' A' ' 55' ' ' LEU . 15.0 mm-40 -72.08 -20.17 61.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 74.02 110.871 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 1.008 HD21 HG21 ' A' ' 75' ' ' VAL . 14.5 mt -86.34 153.68 56.49 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.59 0.71 . . . . 74.24 110.884 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.501 ' CG ' ' HD2' ' A' ' 73' ' ' ARG . 54.8 Cg_endo -69.66 -162.94 0.1 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.696 2.264 . . . . 74.11 112.426 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.89 -29.48 1.68 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.252 -0.431 . . . . 74.11 110.846 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.56 39.31 3.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 75.13 110.871 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.72 119.98 3.94 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.599 0.714 . . . . 61.54 110.923 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.583 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.8 Cg_endo -69.8 132.57 23.54 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 53.44 112.322 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.902 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.92 161.13 40.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.435 . . . . 74.22 110.941 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.491 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.9 m-85 -100.02 153.92 18.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 72.2 110.914 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 1.008 HG21 HD21 ' A' ' 67' ' ' LEU . 73.3 t -153.4 133.15 3.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 51.52 111.09 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.678 HG23 ' HE1' ' A' ' 40' ' ' MET . 41.5 t -120.05 100.04 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 75.35 111.038 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -93.46 138.96 31.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.91 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.451 ' CB ' ' HG ' ' A' ' 92' ' ' LEU . 16.5 t -117.08 96.15 5.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.899 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.722 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.1 t80 -82.14 161.49 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.904 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG3' ' CE2' ' A' ' 90' ' ' TYR . 18.7 tttt -110.69 107.52 17.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 62.11 110.956 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.24 128.56 48.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.219 -0.446 . . . . 75.21 110.862 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 83' ' ' HIS . 50.2 t -98.26 161.44 2.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.086 -0.506 . . . . 75.02 111.131 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.566 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.4 m-70 -99.58 -93.61 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.096 -0.502 . . . . 64.04 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.45 -47.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 64.1 110.922 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.11 -12.33 49.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 71.35 110.856 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.21 14.31 3.72 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.686 -0.769 . . . . 74.04 112.428 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 33.8 mmt180 -109.05 142.74 39.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.84 0.352 . . . . 73.45 110.881 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.433 HG21 ' HE2' ' A' ' 80' ' ' LYS . 2.9 p -142.34 126.5 15.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.218 -0.446 . . . . 74.35 111.093 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 50.4 m -121.8 152.93 38.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 63.01 110.825 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.561 ' CE2' ' HG3' ' A' ' 80' ' ' LYS . 3.7 m-85 -104.47 93.81 6.32 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.598 0.713 . . . . 44.33 110.891 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.413 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.1 Cg_endo -69.74 94.23 0.53 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.413 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.8 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.66 136.22 47.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 71.14 110.912 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.506 ' SG ' HD21 ' A' ' 144' ' ' LEU . 94.2 m -135.34 156.9 48.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 55.11 110.863 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.581 ' HD2' HG23 ' A' ' 126' ' ' VAL . 71.8 t80 -101.69 105.18 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.488 . . . . 73.41 110.861 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 95.5 mt -92.68 101.77 12.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 74.24 111.132 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 98' ' ' SER . 1.3 t80 -79.61 98.03 6.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 70.42 110.854 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.484 ' HB3' ' NE ' ' A' ' 73' ' ' ARG . 0.2 OUTLIER -77.96 101.42 6.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 64.11 110.804 -179.758 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.599 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 53.2 p -134.45 97.19 14.7 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.662 0.744 . . . . 72.42 110.863 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -173.15 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.673 2.249 . . . . 75.44 112.321 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 3.6 p -115.99 -17.26 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 75.22 111.121 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.0 -2.0 86.19 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.738 . . . . 72.05 112.422 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 6.2 p -80.77 -175.41 5.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.916 0.389 . . . . 73.24 110.861 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.4 150.6 37.34 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 121.551 0.691 . . . . 73.21 110.888 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 -13.09 34.08 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.697 2.265 . . . . 62.12 112.347 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -76.6 -36.13 57.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.218 -0.446 . . . . 71.23 110.897 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.502 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.0 mm100 -89.54 -57.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 73.13 110.886 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.428 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.94 -40.66 0.2 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 72.33 110.886 -179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 11.6 mtm -61.24 -44.23 97.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 71.41 110.91 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.502 ' N ' ' O ' ' A' ' 106' ' ' GLN . 79.8 mtp -53.46 -36.19 61.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.456 . . . . 63.01 110.855 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.674 ' CE2' HG12 ' A' ' 42' ' ' VAL . 21.1 m-85 -87.5 -35.38 18.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.922 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.98 -27.33 65.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 61.13 111.169 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -93.09 -19.21 36.96 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.757 -0.735 . . . . 44.34 112.458 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 15.5 m -105.46 -17.03 14.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.876 0.37 . . . . 64.03 110.876 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.591 ' O ' HG23 ' A' ' 118' ' ' VAL . 16.5 ttpt -45.2 -54.8 6.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.096 -0.502 . . . . 73.21 110.945 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -59.3 -41.14 88.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 64.12 110.849 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.5 tpp180 -57.89 -56.03 27.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.52 110.908 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 49' ' ' VAL . 8.2 tp -60.31 -56.65 18.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.125 -0.489 . . . . 64.25 110.959 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 114' ' ' LYS . 97.8 t -46.9 -52.85 3.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 73.41 111.129 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -53.22 -36.24 60.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.919 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.803 HG21 HG21 ' A' ' 16' ' ' VAL . 4.4 m -64.17 -44.21 92.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.445 . . . . 64.13 111.118 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.085 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.99 -8.78 57.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.245 -0.434 . . . . 65.3 111.134 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 58.66 37.31 25.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.122 -0.49 . . . . 52.42 110.925 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.45 HD13 ' HB2' ' A' ' 94' ' ' PHE . 9.7 mt -92.75 84.23 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.074 -0.512 . . . . 75.5 110.937 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.2 m -48.08 -40.36 22.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.194 -0.457 . . . . 75.43 111.157 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mtmt -87.37 97.34 10.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 73.01 110.907 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.581 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -121.71 119.05 57.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.438 . . . . 73.23 111.121 179.906 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -109.15 163.6 13.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 63.22 110.824 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -130.74 121.51 25.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 74.45 110.944 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.534 HG22 ' HB3' ' A' ' 134' ' ' ASP . 3.9 pt -98.7 128.53 50.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 64.54 111.134 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -72.9 -17.92 61.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.109 -0.496 . . . . 65.54 110.875 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -167.47 144.11 4.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 63.51 111.169 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.52 HG23 HH22 ' A' ' 73' ' ' ARG . 21.8 p -38.17 -48.82 1.3 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.4 111.122 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -38.92 -45.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 64.21 110.918 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.534 ' HB3' HG22 ' A' ' 129' ' ' ILE . 3.3 m-20 -48.52 -46.44 38.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.198 -0.456 . . . . 72.32 110.894 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.523 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.8 OUTLIER -55.99 83.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.123 -0.49 . . . . 50.02 110.884 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.6 OUTLIER -126.88 142.33 51.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.257 -0.429 . . . . 64.25 111.104 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -38.95 -47.71 1.49 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.289 -0.414 . . . . 75.01 110.879 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.408 ' C ' ' N ' ' A' ' 140' ' ' LEU . 15.3 m -67.48 -61.51 1.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 74.32 111.136 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.419 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 11.7 t90 -43.05 -24.17 0.06 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.203 -0.453 . . . . 75.32 110.916 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.722 HD21 ' HB2' ' A' ' 79' ' ' TYR . 9.2 tp -84.47 -63.11 1.4 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.436 . . . . 74.13 110.932 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.416 ' CE ' ' OH ' ' A' ' 79' ' ' TYR . 0.5 OUTLIER -54.72 -15.46 1.87 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.892 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -70.66 -51.85 25.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 73.52 110.874 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.04 -37.38 87.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 71.13 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.538 HD11 HD11 ' A' ' 140' ' ' LEU . 20.4 mt -69.99 -50.88 37.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.916 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -35.05 -69.01 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 64.21 111.09 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -173.75 39.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 71.2 110.861 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 78.35 145.72 2.81 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.76 -0.733 . . . . 72.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 115.2 3.98 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.676 2.251 . . . . 64.52 112.391 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 5.8 t -124.84 136.47 53.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 73.3 110.844 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 78.4 p -100.09 131.71 45.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.846 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 C-N-CA 120.751 -0.738 . . . . 15.24 112.501 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.423 -0.271 . . . . 62.3 112.423 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.0 p -112.45 128.55 56.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.88 0.371 . . . . 45.11 110.886 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.2 p 41.23 89.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 74.21 110.844 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.91 153.28 9.04 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.726 -0.749 . . . . 63.42 112.555 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 m 58.58 166.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.888 0.375 . . . . 53.01 110.865 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -131.51 109.68 10.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 53.22 110.828 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -167.69 -178.87 40.05 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.725 -0.75 . . . . 61.33 112.475 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -76.02 123.38 25.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.937 0.399 . . . . 64.43 110.786 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 23.3 p-10 -160.26 85.14 0.73 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 75.53 110.939 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 39.6 m -90.64 129.81 36.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 54.25 110.866 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.5 mt -130.71 176.2 8.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 74.55 110.926 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.702 HG22 ' O ' ' A' ' 12' ' ' VAL . 7.9 p -92.7 43.24 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 73.11 111.187 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.407 ' C ' ' O ' ' A' ' 12' ' ' VAL . 57.8 t -35.81 145.38 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.41 111.127 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 59.6 m -121.47 -174.0 2.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.892 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -114.01 158.29 21.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 72.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 HG21 ' A' ' 120' ' ' THR . 5.9 p -87.36 97.32 6.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.207 -0.451 . . . . 32.42 111.115 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.492 ' OD2' HG12 ' A' ' 50' ' ' VAL . 13.1 t70 -33.24 140.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.686 0.755 . . . . 74.54 110.823 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.3 Cg_endo -69.66 -36.13 11.65 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.778 2.319 . . . . 72.34 112.369 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.73 -25.28 62.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 75.41 110.943 -179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.538 ' O ' HD23 ' A' ' 20' ' ' LEU . 1.2 tt -88.6 -34.34 17.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.495 . . . . 73.51 110.855 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.495 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 6.2 ttmt -48.85 -48.48 41.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 64.42 110.954 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -63.77 -45.84 87.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 75.33 110.914 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.9 m -44.36 -42.44 6.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.152 -0.477 . . . . 61.13 111.168 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.01 HD13 ' HB2' ' A' ' 121' ' ' ALA . 13.4 mt -71.12 -56.19 6.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.27 -0.423 . . . . 64.53 110.901 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.545 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -45.33 -27.39 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 72.24 110.87 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.58 -46.86 7.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.913 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 38' ' ' ILE . 15.2 t80 -52.06 -21.67 3.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.885 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.543 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -86.04 -28.44 24.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.873 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.545 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.2 OUTLIER -126.08 37.6 4.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 71.42 110.855 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.573 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -88.07 -174.82 4.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 33' ' ' THR . 1.9 mttm -62.32 -8.65 6.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.902 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' A' ' 31' ' ' LYS . 1.6 mp0 31.21 -135.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 74.34 110.884 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.915 HG22 ' OH ' ' A' ' 90' ' ' TYR . 2.2 p 51.71 16.47 0.48 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 30.43 111.14 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.499 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.7 OUTLIER -155.03 120.07 4.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.243 -0.435 . . . . 53.23 110.89 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -59.06 116.2 3.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.43 110.903 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.61 164.11 28.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 54.45 111.04 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -141.16 143.64 34.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 35.05 111.168 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.616 HD11 ' CD1' ' A' ' 27' ' ' PHE . 7.1 mt -123.05 102.81 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 74.32 111.133 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 HG22 ' A' ' 75' ' ' VAL . 4.8 mt -86.71 114.12 25.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.163 -0.471 . . . . 72.31 111.187 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.6 OUTLIER -111.18 152.59 26.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.227 -0.442 . . . . 64.42 110.82 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.5 pttt -134.73 175.31 9.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.869 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.838 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -123.41 118.85 55.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.177 -0.465 . . . . 73.2 111.061 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.5 m-20 -79.3 124.03 28.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 52.14 110.856 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -69.98 -20.7 63.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 52.3 110.847 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -78.2 -27.05 47.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 75.11 110.902 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 47' ' ' GLN . 6.8 mtp180 -120.37 4.0 10.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 75.42 110.843 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.2 mm-40 35.65 53.76 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 72.53 110.959 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.4 ' CG ' HG13 ' A' ' 50' ' ' VAL . 4.4 ptm -146.43 150.99 36.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.127 -0.488 . . . . 74.25 110.894 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.879 HG11 HD13 ' A' ' 117' ' ' LEU . 60.1 t -82.77 106.73 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 73.14 111.08 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.492 HG12 ' OD2' ' A' ' 17' ' ' ASP . 25.3 m -117.05 140.05 41.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.452 . . . . 71.32 111.144 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.35 140.56 10.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.216 -0.447 . . . . 64.42 110.896 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.416 ' HG2' ' NH2' ' A' ' 73' ' ' ARG . 7.7 tp10 -107.56 -44.77 4.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.878 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -157.97 165.59 34.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.927 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -148.62 111.2 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.852 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.412 HD13 ' HG3' ' A' ' 66' ' ' GLU . 8.2 mt -115.56 127.89 55.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.085 -0.507 . . . . 72.42 110.975 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -107.91 162.94 13.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.185 -0.461 . . . . 63.34 110.882 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 49.34 49.01 20.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 63.33 110.916 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.928 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -121.67 140.51 45.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 73.23 111.105 179.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.487 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.52 169.46 17.32 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.701 0.763 . . . . 73.34 110.833 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.1 Cg_endo -69.86 2.63 3.41 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.718 2.278 . . . . 73.32 112.301 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.644 ' O ' HD13 ' A' ' 65' ' ' LEU . 10.2 mt-10 -102.4 -29.13 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 72.42 110.883 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -79.29 -43.69 23.16 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 73.23 110.984 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.603 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -50.45 -53.16 31.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 72.21 110.902 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.72 -35.49 63.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 73.2 110.932 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 61' ' ' GLU . 6.7 mp -70.16 -37.97 75.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 64.15 110.896 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 55' ' ' LEU . 26.0 mm-40 -68.71 -32.82 72.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.873 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.781 HD21 HG21 ' A' ' 75' ' ' VAL . 75.4 mt -65.06 149.58 96.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.681 0.753 . . . . 70.33 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.452 ' CG ' ' HD3' ' A' ' 73' ' ' ARG . 53.8 Cg_endo -69.76 -165.27 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.603 2.202 . . . . 72.35 112.401 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.72 -30.13 4.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 75.21 110.971 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 19.5 mmt85 -139.14 42.88 2.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.191 -0.459 . . . . 71.11 110.863 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.421 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 43.6 mt-30 -141.44 108.25 6.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.617 0.723 . . . . 53.42 110.917 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.579 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 53.9 Cg_endo -69.78 140.51 42.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.647 2.232 . . . . 62.12 112.356 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.452 ' HD3' ' CG ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -166.59 168.47 14.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 74.33 110.858 -179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.658 ' CD2' HD22 ' A' ' 117' ' ' LEU . 26.2 m-85 -96.51 148.69 22.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 75.22 110.891 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.781 HG21 HD21 ' A' ' 67' ' ' LEU . 53.5 t -149.95 124.76 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.55 111.175 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 56.0 t -108.42 99.29 8.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 70.23 111.135 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.405 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.3 t80 -92.55 137.39 32.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 74.33 110.906 -179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.5 t -119.81 96.61 5.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 61.43 110.871 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -85.47 159.32 19.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.47 . . . . 75.31 110.906 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -111.33 108.0 17.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.109 -0.496 . . . . 61.44 110.86 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -101.62 129.73 47.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.933 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 83' ' ' HIS . 12.9 t -97.79 159.1 3.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.073 -0.512 . . . . 65.34 111.117 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.455 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.9 m-70 -96.22 -89.96 0.25 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 64.14 110.917 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 172.05 -42.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 72.52 110.841 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.8 -12.32 61.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 74.32 110.848 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.27 11.42 3.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 43.33 112.441 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -112.34 144.06 42.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 72.23 110.854 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.404 ' HB ' HG13 ' A' ' 82' ' ' VAL . 5.0 p -141.19 129.43 23.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.15 111.132 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.4 m -121.48 152.94 38.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 63.41 110.837 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.915 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.3 OUTLIER -109.67 94.58 17.07 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.669 0.747 . . . . 71.25 110.925 -179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.77 102.36 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.681 2.254 . . . . 74.1 112.305 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.602 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -77.36 126.99 31.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 72.23 110.915 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.435 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 83.5 m -125.74 157.77 36.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 73.02 110.933 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.473 ' HB2' HD13 ' A' ' 123' ' ' LEU . 69.4 t80 -101.54 104.94 15.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 72.44 110.88 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.5 mt -93.42 112.01 25.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.14 111.095 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -94.46 108.19 20.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 70.12 110.875 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.5 t -78.26 99.65 6.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 62.31 110.839 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.439 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 4.7 t -134.22 98.8 13.82 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.738 0.78 . . . . 64.42 110.842 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.1 Cg_endo -69.79 -169.54 0.34 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.684 2.256 . . . . 73.34 112.277 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.1 p -114.33 -16.31 9.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.151 -0.477 . . . . 52.13 111.086 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -91.4 -5.23 67.43 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.738 -0.744 . . . . 71.24 112.459 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.7 p -64.35 179.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.917 0.389 . . . . 53.32 110.805 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.02 151.14 39.42 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.583 0.706 . . . . 71.34 110.914 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 -14.18 35.95 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.69 2.26 . . . . 64.1 112.382 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -75.14 -36.62 61.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 65.13 110.959 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.475 ' O ' ' N ' ' A' ' 109' ' ' MET . 6.4 mm100 -91.27 -57.24 2.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.101 -0.499 . . . . 70.22 110.926 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.94 -38.67 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 75.3 110.937 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 18.6 mtm -67.11 -38.1 85.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.884 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.1 mtp -59.86 -28.47 67.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.9 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.838 ' CE2' HG12 ' A' ' 42' ' ' VAL . 58.1 m-85 -95.41 -39.47 9.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 71.4 110.86 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.13 -29.79 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 71.51 111.08 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -91.72 -21.18 34.72 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.728 -0.749 . . . . 72.03 112.488 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -105.49 -5.6 20.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.974 0.416 . . . . 54.2 110.863 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 110' ' ' TYR . 19.4 ttpt -55.24 -64.57 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.084 -0.507 . . . . 72.24 110.841 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -48.85 -40.82 30.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.03 110.914 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -55.14 -53.48 55.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 73.45 110.846 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.879 HD13 HG11 ' A' ' 49' ' ' VAL . 7.8 tp -65.09 -57.35 8.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.918 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 94' ' ' PHE . 94.4 t -47.38 -55.13 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 74.24 111.159 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -51.92 -38.5 56.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.458 . . . . 75.34 110.904 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.903 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -60.81 -45.13 95.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 54.02 111.145 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.01 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -69.47 -26.38 64.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.273 -0.421 . . . . 65.2 111.143 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' CB ' ' O ' ' A' ' 121' ' ' ALA . 5.1 tt0 79.66 34.66 0.17 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.173 -0.467 . . . . 75.3 110.922 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.9 mt -88.5 114.08 24.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 62.42 110.936 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 22.3 m -71.3 -45.33 63.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 62.4 111.065 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.0 mtmt -80.67 115.34 20.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.238 -0.437 . . . . 72.23 110.914 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 38.4 t -123.84 110.72 26.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 74.43 111.12 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 14.8 m-30 -103.3 163.35 12.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.169 -0.469 . . . . 73.12 110.868 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -139.99 112.55 7.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.22 110.796 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.612 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 6.1 pt -92.38 132.66 36.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.213 -0.449 . . . . 72.21 111.105 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -77.91 -21.43 51.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 64.22 110.885 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.435 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.0 OUTLIER -165.27 138.82 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 54.21 111.094 -179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.435 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.8 p -34.72 -47.93 0.36 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 63.43 111.2 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -40.1 -52.14 2.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 72.2 110.861 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -42.7 -47.34 5.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.153 -0.476 . . . . 73.0 110.884 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.7 tp -58.22 92.7 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 65.42 110.952 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.2 p -136.51 152.94 51.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 70.1 111.164 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -41.74 -36.89 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 53.23 110.834 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.558 HG22 ' HG3' ' A' ' 142' ' ' GLU . 5.2 m -80.48 -63.47 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 65.23 111.198 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.612 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.7 t90 -45.6 -21.32 0.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.19 -0.459 . . . . 75.53 110.911 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.642 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -88.74 -60.4 1.97 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 72.53 110.955 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.642 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.3 mtpm? -60.34 -18.87 52.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 71.21 110.891 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.558 ' HG3' HG22 ' A' ' 138' ' ' THR . 2.7 mt-10 -72.84 -45.75 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 63.42 110.886 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 12.2 mmtt -63.88 -35.72 81.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 55.45 110.867 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.435 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.0 mt -72.42 -53.23 12.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.234 -0.439 . . . . 71.41 110.916 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -39.89 -75.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 62.42 111.043 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -157.36 34.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.269 -0.423 . . . . 65.43 110.815 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 67.91 179.82 16.66 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 60.3 112.457 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -175.14 1.06 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.666 2.244 . . . . 60.04 112.313 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -163.33 154.44 16.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 71.21 110.852 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.39 165.65 32.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.151 -0.477 . . . . 65.31 110.946 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 C-N-CA 120.752 -0.737 . . . . 71.22 112.447 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.48 -0.248 . . . . 63.41 112.48 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m -161.43 -57.56 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.877 0.37 . . . . 54.31 110.838 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.27 140.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.3 110.843 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.16 -144.24 18.36 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.751 -0.737 . . . . 61.42 112.567 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.2 p -155.96 129.92 8.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.889 0.376 . . . . 74.52 110.841 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.0 p -120.13 164.58 15.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.491 . . . . 74.25 110.868 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 111.09 133.08 6.22 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.761 -0.733 . . . . 54.31 112.489 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.5 t -40.76 152.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.874 0.369 . . . . 60.31 110.891 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -102.6 42.09 1.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 63.13 110.889 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.5 m -137.83 117.83 13.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 71.14 110.901 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.6 mt -129.44 -179.43 5.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 74.02 110.944 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.721 HG22 ' O ' ' A' ' 12' ' ' VAL . 8.0 p -95.74 39.97 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 74.55 111.196 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.446 ' C ' ' O ' ' A' ' 12' ' ' VAL . 76.2 t -34.08 122.27 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.108 -0.496 . . . . 61.11 111.096 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.99 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -99.74 -174.9 2.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 73.23 110.885 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -123.84 141.6 51.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.934 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.816 HG11 HG21 ' A' ' 120' ' ' THR . 26.3 t -69.54 95.29 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 74.3 111.117 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.498 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 17.7 t70 -30.79 141.65 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.601 0.715 . . . . 75.24 110.907 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.477 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.6 Cg_endo -69.7 -30.62 22.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 70.0 112.369 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.498 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -75.04 -24.91 58.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 75.52 110.85 -179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.745 HD11 ' HG2' ' A' ' 40' ' ' MET . 4.0 tt -90.43 -47.41 7.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.507 . . . . 73.31 110.92 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 20' ' ' LEU . 4.7 ttmt -35.04 -46.12 0.31 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.35 110.968 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.492 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -60.86 -44.21 97.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 73.5 110.853 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.495 ' N ' ' O ' ' A' ' 20' ' ' LEU . 13.6 m -49.14 -45.05 43.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 71.03 111.141 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.007 HD13 ' HB2' ' A' ' 121' ' ' ALA . 14.4 mt -66.11 -51.85 54.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 74.24 110.914 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -55.47 -30.8 61.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.879 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -83.19 -40.34 19.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 62.41 110.928 179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.738 ' CD2' HD21 ' A' ' 92' ' ' LEU . 3.9 t80 -52.01 -43.93 63.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.279 -0.419 . . . . 75.12 110.794 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.458 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -60.68 -33.31 72.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 64.44 110.887 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -124.86 40.58 3.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.486 . . . . 64.13 110.945 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -69.17 176.89 2.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 64.1 110.968 -179.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -106.38 39.25 1.86 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.235 -0.439 . . . . 75.32 110.901 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 11.6 mt-10 -119.45 174.33 6.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 73.25 110.881 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.6 p -147.75 32.42 0.86 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 70.52 111.14 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -135.42 -174.88 3.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.247 -0.433 . . . . 73.22 110.865 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -86.15 118.57 25.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 60.22 110.907 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -130.83 157.31 43.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.137 -0.483 . . . . 53.15 111.199 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.81 150.66 51.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.248 -0.433 . . . . 53.3 111.149 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.416 HD11 ' CD1' ' A' ' 27' ' ' PHE . 10.1 mt -132.67 104.72 7.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.265 -0.425 . . . . 54.31 111.105 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.433 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -89.72 116.69 31.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.157 -0.474 . . . . 71.53 111.155 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.79 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.7 OUTLIER -111.32 132.72 54.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.883 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' A' ' 50' ' ' VAL . 22.6 pttt -106.46 177.91 4.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 74.35 110.923 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.945 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.1 p -130.39 111.84 21.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 62.13 111.062 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.49 ' CG ' ' NH2' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -71.27 121.66 18.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.131 -0.486 . . . . 75.55 110.831 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.2 tttt -66.7 -26.73 67.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.28 -0.418 . . . . 75.44 110.886 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.03 -45.26 64.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 71.4 110.9 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.725 ' NH2' HG21 ' A' ' 50' ' ' VAL . 20.4 mtm180 -101.43 3.44 40.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 61.13 110.838 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 43' ' ' ASP . 0.9 OUTLIER 36.71 52.51 1.01 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.264 -0.426 . . . . 72.24 110.985 -179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 48' ' ' MET . 4.1 ptm -144.19 138.28 27.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 72.52 110.905 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.99 HG23 ' SG ' ' A' ' 14' ' ' CYS . 24.4 t -73.03 108.06 4.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 74.24 111.121 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.725 HG21 ' NH2' ' A' ' 46' ' ' ARG . 32.8 m -115.73 146.54 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.111 -0.495 . . . . 73.13 111.127 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.734 ' N ' HD12 ' A' ' 20' ' ' LEU . 1.4 tp -50.89 138.36 19.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.866 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.9 -43.59 3.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.954 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -159.76 170.83 20.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 72.4 110.874 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HG3' HD11 ' A' ' 51' ' ' LEU . 4.2 mt-10 -152.24 108.7 3.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.472 . . . . 72.54 110.843 -179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.437 ' CD1' ' HG3' ' A' ' 66' ' ' GLU . 10.8 mt -108.09 128.45 54.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 73.2 110.897 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.441 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 10.2 mp0 -108.01 162.05 14.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 71.31 110.961 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.441 ' ND2' ' HB3' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 45.07 53.0 8.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.445 . . . . 75.42 110.911 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.986 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -123.44 139.96 48.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 72.23 111.045 179.953 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -81.79 168.62 22.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.636 0.731 . . . . 74.44 110.856 -179.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.7 1.88 4.0 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.662 2.241 . . . . 71.43 112.363 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.563 ' O ' HD13 ' A' ' 65' ' ' LEU . 11.9 mt-10 -102.81 -28.47 12.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 74.03 110.803 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.26 -44.38 25.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 60.14 110.918 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.692 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.3 OUTLIER -49.94 -51.37 41.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 72.22 110.974 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.29 -37.07 64.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 72.23 110.928 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.563 HD13 ' O ' ' A' ' 61' ' ' GLU . 7.1 mp -68.29 -37.6 80.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 73.0 110.961 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HG3' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mm-40 -69.31 -32.28 71.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 71.11 110.878 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.66 HD21 HG21 ' A' ' 75' ' ' VAL . 81.0 mt -66.33 150.57 96.94 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.62 0.724 . . . . 63.24 110.874 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.485 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.8 Cg_endo -69.77 -178.48 2.37 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.703 2.269 . . . . 51.45 112.378 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -106.36 -25.21 12.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.898 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -147.39 51.8 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 72.43 110.912 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.485 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 76.3 mt-30 -147.62 107.8 3.79 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.607 0.718 . . . . 74.13 110.871 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.543 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.73 129.8 18.27 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.676 2.251 . . . . 73.32 112.365 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -152.06 179.59 8.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 73.03 110.821 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.463 ' CE1' ' HB3' ' A' ' 110' ' ' TYR . 26.1 m-85 -111.27 143.47 41.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.123 -0.49 . . . . 75.22 110.863 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.66 HG21 HD21 ' A' ' 67' ' ' LEU . 46.6 t -149.87 139.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.478 . . . . 65.34 111.175 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.79 HG23 ' CE ' ' A' ' 40' ' ' MET . 87.3 t -119.63 96.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 74.4 111.138 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.565 ' HB2' HD12 ' A' ' 95' ' ' ILE . 10.3 t80 -87.08 130.42 34.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.22 110.939 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -112.26 96.73 6.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 63.24 110.851 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.481 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 77.2 t80 -82.34 166.86 19.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.484 . . . . 74.5 110.987 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.547 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 63.0 tttt -121.4 102.15 8.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 50.11 110.95 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.667 ' O ' HG23 ' A' ' 88' ' ' VAL . 0.5 OUTLIER -96.42 137.42 35.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.95 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.513 HG13 ' HB ' ' A' ' 88' ' ' VAL . 5.9 t -105.44 158.67 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 53.5 111.207 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.422 ' N ' HG12 ' A' ' 82' ' ' VAL . 21.3 m-70 -96.29 -92.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 60.14 110.899 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.61 -41.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.174 -0.466 . . . . 64.33 110.913 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -72.11 -7.9 51.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 62.44 110.838 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 119.63 14.76 5.62 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.735 -0.745 . . . . 52.12 112.44 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -113.02 138.05 50.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.806 0.336 . . . . 44.12 110.912 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.667 HG23 ' O ' ' A' ' 81' ' ' TYR . 6.3 p -139.44 131.79 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 54.44 111.158 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 43.3 m -123.49 155.27 37.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 62.1 110.884 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.547 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 1.1 m-85 -104.5 94.94 7.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.687 0.756 . . . . 72.24 110.927 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.4 Cg_endo -69.71 96.31 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.714 2.276 . . . . 75.11 112.334 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.738 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -72.1 138.36 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.226 -0.443 . . . . 72.32 110.935 179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.425 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 90.3 m -139.79 157.98 44.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.11 -0.496 . . . . 54.21 110.875 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.565 ' CZ ' HG22 ' A' ' 118' ' ' VAL . 70.9 t80 -101.39 105.98 17.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 64.44 110.866 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.565 HD12 ' HB2' ' A' ' 77' ' ' TYR . 84.6 mt -93.33 114.25 29.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 64.23 111.133 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -95.95 102.55 14.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.112 -0.495 . . . . 75.02 110.848 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.496 ' HA ' HD11 ' A' ' 129' ' ' ILE . 44.7 t -78.64 90.59 4.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.891 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 101.83 20.34 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-O 121.646 0.736 . . . . 52.2 110.867 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -168.99 0.3 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.674 2.249 . . . . 74.14 112.397 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.0 p -106.88 -26.53 3.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.29 -0.413 . . . . 74.23 111.124 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -82.32 -7.53 87.53 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.748 -0.739 . . . . 73.35 112.444 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.4 p -55.74 168.41 0.44 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.849 0.357 . . . . 70.5 110.877 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.17 150.69 38.02 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.6 0.714 . . . . 73.35 110.903 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -21.08 33.97 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.685 2.257 . . . . 72.32 112.388 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -72.66 -30.83 64.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 71.42 110.839 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.434 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.3 mm100 -93.23 -52.86 4.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 62.44 110.888 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -44.59 -30.47 0.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.44 . . . . 74.33 110.982 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 7.5 mtm -74.5 -34.74 63.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 74.23 110.891 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.469 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . 79.5 mtp -61.18 -37.73 83.97 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.902 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.945 ' CE2' HG12 ' A' ' 42' ' ' VAL . 31.9 m-85 -92.87 -42.57 9.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.99 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 107' ' ' GLN . . . -60.62 -26.07 66.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 61.52 111.077 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.39 -22.9 23.26 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.747 -0.74 . . . . 62.23 112.479 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -111.61 6.92 20.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 60.32 110.887 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 110' ' ' TYR . 27.8 ttpt -61.91 -67.92 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.086 -0.507 . . . . 71.4 110.88 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -49.32 -42.28 41.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 72.2 110.923 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 7.4 tpp85 -58.41 -51.12 71.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 74.41 110.882 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.751 ' C ' HD13 ' A' ' 117' ' ' LEU . 2.5 tm? -65.79 -55.31 17.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.171 -0.468 . . . . 73.21 110.887 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.565 HG22 ' CZ ' ' A' ' 94' ' ' PHE . 93.8 t -47.12 -55.65 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.224 -0.444 . . . . 71.14 111.098 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -45.41 -47.34 13.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 74.22 110.889 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.816 HG21 HG11 ' A' ' 16' ' ' VAL . 50.6 m -55.5 -46.06 77.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.24 -0.437 . . . . 73.44 111.134 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.007 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.14 -5.64 28.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.246 -0.434 . . . . 74.41 111.139 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 56.89 61.26 2.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 65.4 110.885 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 10.2 mt -123.57 102.88 8.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.51 110.947 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.538 HG23 ' HG2' ' A' ' 125' ' ' LYS . 7.4 t -71.82 -28.04 63.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 62.24 111.116 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.538 ' HG2' HG23 ' A' ' 124' ' ' THR . 0.7 OUTLIER -86.17 88.96 7.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.253 -0.431 . . . . 75.32 110.917 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 HG11 ' A' ' 118' ' ' VAL . 10.3 t -101.76 107.05 20.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 73.23 111.147 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 11.6 m-30 -106.75 143.62 34.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 72.24 110.908 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -119.71 111.18 17.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 74.02 110.787 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.594 HG23 ' CZ2' ' A' ' 139' ' ' TRP . 2.9 pt -89.17 127.25 41.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 52.15 111.148 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -71.7 -12.89 61.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 71.43 110.902 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.436 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.2 t -175.69 141.94 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 73.12 111.149 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' O ' ' A' ' 131' ' ' THR . 20.9 p -34.71 -49.09 0.41 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 72.11 111.091 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -52.83 2.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.454 . . . . 73.21 110.883 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 136' ' ' THR . 0.6 OUTLIER -40.69 -47.46 2.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.899 -179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.692 HD21 ' HB3' ' A' ' 63' ' ' LEU . 2.2 tp -57.18 80.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 72.22 110.87 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.501 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -123.75 145.42 49.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 72.31 111.096 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.467 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 5.6 tt0 -36.42 -42.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 61.11 110.88 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.528 HG22 ' HG3' ' A' ' 142' ' ' GLU . 8.4 m -74.86 -58.87 3.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 61.1 111.148 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.594 ' CZ2' HG23 ' A' ' 129' ' ' ILE . 1.4 t90 -48.18 -19.75 0.31 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.264 -0.425 . . . . 74.33 110.925 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.72 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.3 OUTLIER -91.22 -60.88 1.78 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.881 179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.72 ' N ' HD13 ' A' ' 140' ' ' LEU . 1.8 mtpm? -57.92 -22.58 49.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.13 110.901 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.528 ' HG3' HG22 ' A' ' 138' ' ' THR . 6.7 mt-10 -70.94 -47.43 59.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 74.0 110.91 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 13.7 mmtt -60.09 -36.65 77.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 62.42 110.924 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.425 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 10.9 mt -74.59 -51.57 14.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.262 -0.426 . . . . 71.43 110.963 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.95 -60.38 3.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 23.53 111.14 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 69.7 p -86.32 31.73 0.65 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 63.52 110.916 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 42.65 -162.21 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.727 -0.749 . . . . 44.12 112.558 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -173.81 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.694 2.263 . . . . 65.41 112.365 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 51.0 m 44.79 91.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 75.34 110.869 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 53.2 p -160.09 127.02 4.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 52.11 110.851 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.746 -0.74 . . . . 73.13 112.517 -179.971 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.518 -0.233 . . . . 73.2 112.518 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.5 t -153.84 -48.89 0.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 61.44 110.799 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 93.6 p -121.42 154.01 37.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 74.45 110.832 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.07 -81.2 0.2 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.783 -0.723 . . . . 65.11 112.47 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.02 167.79 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.947 0.403 . . . . 70.01 110.825 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.2 m -66.36 176.47 1.81 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 62.14 110.883 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.72 -166.54 24.53 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.798 -0.715 . . . . 65.32 112.419 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.6 p -136.37 138.27 41.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.891 0.377 . . . . 72.31 110.812 -179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -171.25 46.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 72.42 110.826 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.84 163.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.212 -0.449 . . . . 60.41 110.812 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 mt -136.13 177.41 7.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 73.04 110.909 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.82 HG11 ' HG2' ' A' ' 109' ' ' MET . 10.0 p -93.9 43.69 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 75.52 111.082 179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 82.8 t -40.26 119.73 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 74.45 111.063 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 91.6 m -101.78 169.06 9.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 70.05 110.896 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.1 174.19 7.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 70.03 110.899 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.726 HG21 HG21 ' A' ' 120' ' ' THR . 12.2 p -104.32 96.12 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.139 -0.482 . . . . 53.31 111.144 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.487 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.5 t70 -33.11 140.06 0.23 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.564 0.697 . . . . 73.13 110.842 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.2 Cg_endo -69.83 -32.94 17.29 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.607 2.205 . . . . 75.12 112.29 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -69.94 -26.31 64.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.271 -0.422 . . . . 75.25 110.896 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.715 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.2 tt -89.34 -45.52 9.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 72.31 110.934 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.6 ttmt -37.67 -44.62 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.893 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 7.1 mt-10 -66.53 -44.32 82.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.885 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.409 ' N ' ' O ' ' A' ' 20' ' ' LEU . 8.9 m -47.28 -41.64 19.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 74.45 111.118 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.038 HD13 ' HB2' ' A' ' 121' ' ' ALA . 18.3 mt -70.19 -49.79 46.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.169 -0.468 . . . . 62.2 110.912 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -22.92 62.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.443 . . . . 73.12 110.837 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' ARG . 2.0 mmtt -89.41 -40.22 12.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 73.23 110.929 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.6 t80 -58.4 -34.13 70.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.04 110.921 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.431 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -73.28 -38.85 65.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 73.2 110.859 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -118.78 37.73 4.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 73.11 110.894 -179.92 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' LYS . 1.6 ptm180 -65.7 172.3 3.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 72.03 110.934 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 mmmt -98.02 31.04 2.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 60.13 110.923 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -123.38 171.26 9.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 42.25 110.855 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.4 p -140.3 37.05 1.89 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 64.14 111.199 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.497 ' CG ' ' N ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -132.25 174.77 9.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.162 -0.472 . . . . 65.31 110.859 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.497 ' N ' ' CG ' ' A' ' 34' ' ' ASN . 41.4 m-20 -78.07 148.65 34.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 64.02 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.487 ' HB3' ' CZ ' ' A' ' 27' ' ' PHE . . . -159.35 161.17 35.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 55.35 111.072 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.484 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -132.48 146.79 52.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.211 -0.449 . . . . 60.5 111.16 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 ' CG ' ' A' ' 54' ' ' GLU . 5.7 mt -130.8 107.88 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 72.24 111.111 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.569 HG23 ' HG3' ' A' ' 73' ' ' ARG . 5.0 mt -92.71 116.97 35.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.199 -0.455 . . . . 64.11 111.145 179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.535 ' HE1' HG23 ' A' ' 76' ' ' VAL . 0.8 OUTLIER -114.77 152.03 32.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 51.21 110.917 179.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.9 pttt -128.46 177.37 7.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.818 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.883 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.5 OUTLIER -129.28 112.33 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 70.33 111.123 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.436 ' O ' ' N ' ' A' ' 47' ' ' GLN . 11.6 m-20 -74.1 120.06 19.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 75.22 110.878 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -23.34 66.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 70.1 110.873 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -70.6 -42.02 71.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.253 -0.431 . . . . 43.21 110.87 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -103.51 -4.48 23.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 74.5 110.897 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' ASP . 3.5 mm-40 47.84 44.92 18.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 74.11 110.904 -179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -139.01 154.14 48.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.41 110.875 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.667 HG11 HD13 ' A' ' 117' ' ' LEU . 39.3 t -87.03 113.74 25.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 71.15 111.153 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.487 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -121.17 145.63 27.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.48 . . . . 62.24 111.134 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.715 ' N ' HD12 ' A' ' 20' ' ' LEU . 5.5 tt -53.74 147.4 11.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.099 -0.5 . . . . 73.44 110.919 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.635 ' N ' HD23 ' A' ' 51' ' ' LEU . 29.9 tt0 -117.91 -39.31 3.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 75.42 110.892 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.465 ' N ' HD23 ' A' ' 51' ' ' LEU . 19.3 m-20 -165.73 169.38 15.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.123 -0.489 . . . . 71.41 110.855 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' CG ' HG23 ' A' ' 38' ' ' ILE . 7.0 mt-10 -152.63 116.59 4.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.46 . . . . 72.35 110.876 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.519 HD13 ' HG3' ' A' ' 66' ' ' GLU . 2.8 mt -112.04 144.91 40.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 52.03 110.952 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.2 mp0 -125.55 155.76 40.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 74.31 110.941 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 56.01 49.87 14.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.949 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.991 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -127.59 142.31 43.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 71.05 111.147 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.512 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.5 OUTLIER -82.25 170.27 15.46 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.636 0.731 . . . . 63.31 110.849 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.512 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.5 Cg_endo -69.72 -4.14 13.4 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.698 2.265 . . . . 75.24 112.338 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.686 ' O ' HD23 ' A' ' 65' ' ' LEU . 12.1 mt-10 -98.57 -29.34 13.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 61.21 110.893 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.94 -43.94 33.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.479 . . . . 72.32 110.872 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.736 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.2 OUTLIER -48.05 -48.16 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 74.32 110.951 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.558 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.24 -31.57 69.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 70.41 110.932 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.3 mm? -76.19 -16.21 59.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 60.12 110.881 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 55' ' ' LEU . 78.1 mm-40 -88.63 -24.42 22.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 64.34 110.891 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.888 HD22 ' NH1' ' A' ' 73' ' ' ARG . 75.7 mt -79.17 152.61 76.64 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.593 0.711 . . . . 63.11 110.906 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.486 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.75 -167.32 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.627 2.218 . . . . 75.34 112.326 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.423 ' HB2' ' NH1' ' A' ' 70' ' ' ARG . 4.3 pt-20 -119.76 -19.18 8.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 73.55 110.941 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' NH1' ' HB2' ' A' ' 69' ' ' GLU . 36.4 mmt-85 -144.02 43.1 1.44 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 75.25 110.845 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.402 ' HA ' ' HD2' ' A' ' 72' ' ' PRO . 2.1 mt-30 -144.43 102.87 4.66 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.525 0.679 . . . . 74.51 110.917 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.521 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.7 Cg_endo -69.77 133.17 24.9 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.662 2.241 . . . . 55.05 112.332 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.888 ' NH1' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -159.0 176.16 12.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 73.0 110.846 -179.935 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.623 ' CD2' HD22 ' A' ' 117' ' ' LEU . 34.5 m-85 -97.86 143.82 28.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 74.15 110.875 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 13.8 t -144.47 121.55 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 61.43 111.117 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.535 HG23 ' HE1' ' A' ' 40' ' ' MET . 17.0 t -110.76 103.0 14.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 63.34 111.147 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -98.34 138.87 34.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.187 -0.461 . . . . 75.44 110.91 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.1 t -115.07 96.38 5.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.118 -0.492 . . . . 73.2 110.876 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -81.88 159.46 23.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 75.33 110.94 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -115.1 102.23 9.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.063 -0.517 . . . . 72.34 110.937 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -95.99 132.04 41.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.289 -0.414 . . . . 73.5 110.984 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.641 HG23 ' HB ' ' A' ' 88' ' ' VAL . 9.3 p -103.51 155.88 5.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 70.12 111.13 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' O ' ' CB ' ' A' ' 84' ' ' ASP . 22.6 m-70 -94.66 -83.47 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 73.42 110.834 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.42 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.2 OUTLIER 166.16 -46.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.231 -0.441 . . . . 72.12 110.878 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -12.49 40.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 34.41 110.877 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 123.99 18.57 2.86 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.745 -0.74 . . . . 65.3 112.481 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 mmt180 -119.17 133.85 55.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.863 0.363 . . . . 73.13 110.832 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.641 ' HB ' HG23 ' A' ' 82' ' ' VAL . 7.3 p -137.05 128.91 43.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.448 . . . . 64.41 111.143 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 70.8 m -124.01 156.99 35.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 72.42 110.83 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.425 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -110.47 94.6 19.51 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.727 0.775 . . . . 74.52 110.901 -179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.5 Cg_endo -69.74 98.51 0.69 Allowed 'Trans proline' 0 C--O 1.233 0.256 0 C-N-CA 122.597 2.198 . . . . 72.31 112.36 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.99 126.86 30.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.247 -0.433 . . . . 63.45 110.885 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.477 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 92.6 m -124.47 167.87 13.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 45.54 110.898 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.514 ' CG ' HG22 ' A' ' 118' ' ' VAL . 59.9 t80 -114.6 106.94 14.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 65.44 110.87 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.24 128.48 44.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.165 -0.47 . . . . 61.11 111.155 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.558 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.7 t80 -112.65 95.79 5.62 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 65.53 110.912 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.449 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 5.1 t -79.87 97.18 6.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.41 110.939 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 p -123.64 94.27 46.43 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.758 . . . . 62.15 110.828 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 167.82 23.34 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.613 2.208 . . . . 63.23 112.337 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.743 HG22 ' O ' ' A' ' 100' ' ' VAL . 7.3 p -105.69 14.36 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 75.54 111.125 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -106.44 -4.47 37.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.787 -0.72 . . . . 71.43 112.516 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 1.6 t -91.32 -176.47 4.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.844 0.354 . . . . 64.24 110.919 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.75 150.69 46.41 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.572 0.701 . . . . 70.44 110.903 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -17.35 37.85 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.684 2.256 . . . . 71.43 112.402 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -71.94 -29.56 64.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 73.33 110.89 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.413 ' O ' ' N ' ' A' ' 109' ' ' MET . 10.0 mm100 -91.59 -60.78 1.79 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 61.32 110.91 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.9 -39.8 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 53.01 110.884 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -64.34 -44.11 92.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.256 -0.429 . . . . 73.41 110.851 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.82 ' HG2' HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -52.36 -31.36 33.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.257 -0.429 . . . . 70.12 110.87 179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.883 ' CE2' HG12 ' A' ' 42' ' ' VAL . 29.4 m-85 -94.91 -35.46 12.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.439 . . . . 73.53 110.938 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -66.73 -28.09 68.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.115 -0.493 . . . . 65.13 111.043 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -94.72 -30.4 8.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.687 -0.768 . . . . 75.31 112.481 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.7 m -90.24 -13.79 34.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 63.24 110.845 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.558 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 29.4 ttpt -48.7 -57.72 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.14 110.881 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -53.53 -45.53 69.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.255 -0.429 . . . . 61.3 110.876 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -55.3 -56.43 20.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 72.41 110.899 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.667 HD13 HG11 ' A' ' 49' ' ' VAL . 12.9 tp -60.59 -57.04 14.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.228 -0.442 . . . . 71.02 110.971 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.514 HG22 ' CG ' ' A' ' 94' ' ' PHE . 99.2 t -48.23 -50.11 11.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 44.31 111.145 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -54.94 -36.69 65.55 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 75.21 110.952 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.726 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.14 -43.97 90.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.227 -0.442 . . . . 65.14 111.057 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.038 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -70.6 -16.68 62.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 62.41 111.062 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 68.11 33.5 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 54.41 110.86 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.67 96.52 10.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 64.45 110.927 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 4.0 t -62.37 -23.41 66.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.166 -0.47 . . . . 70.25 111.137 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -100.95 100.99 11.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 73.53 110.854 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.489 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.3 OUTLIER -128.72 116.55 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 74.12 111.164 179.841 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 10.5 m-85 -107.45 160.14 15.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 61.34 110.903 179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -127.85 124.37 37.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.869 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.577 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 24.8 pt -105.02 144.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.481 . . . . 64.44 111.136 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -83.38 -17.09 43.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.233 -0.44 . . . . 71.11 110.843 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.3 t -166.07 142.86 5.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 72.51 111.08 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.1 p -41.76 -46.13 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 75.14 111.159 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -40.05 -39.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 61.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.451 ' O ' ' N ' ' A' ' 136' ' ' THR . 1.3 m-20 -54.57 -48.83 71.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 73.05 110.824 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.736 HD21 ' HB3' ' A' ' 63' ' ' LEU . 4.4 tp -52.92 87.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 71.3 110.939 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.451 ' N ' ' O ' ' A' ' 134' ' ' ASP . 2.0 p -130.97 147.25 52.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 64.24 111.127 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.465 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.6 tt0 -38.89 -38.22 0.42 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.896 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.443 ' O ' ' N ' ' A' ' 140' ' ' LEU . 4.6 m -76.81 -68.33 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.058 -0.519 . . . . 71.23 111.213 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.577 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 1.1 t90 -41.64 -24.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 61.01 110.972 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -84.76 -60.75 1.96 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 70.11 110.906 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 5.0 mtpt -56.22 -26.21 50.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 71.34 110.956 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -64.54 -46.28 83.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.874 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.573 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 8.1 mmtt -64.89 -34.04 77.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 71.13 110.835 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.477 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 17.6 mt -74.07 -45.11 51.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.255 -0.43 . . . . 75.23 110.892 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -54.78 -178.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.21 -0.45 . . . . 54.14 111.107 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -161.88 87.01 0.64 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 73.04 110.827 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -125.62 -158.91 10.12 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 43.12 112.528 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.79 -174.56 0.94 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.734 2.289 . . . . 75.24 112.351 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.25 114.73 22.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 71.1 110.907 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -118.73 120.58 37.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 74.33 110.798 -179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 C-N-CA 120.737 -0.744 . . . . 25.45 112.478 -179.993 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.516 -0.234 . . . . 70.32 112.516 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 67.94 114.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.849 0.357 . . . . 63.42 110.819 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -46.83 134.44 10.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 71.4 110.823 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.54 -49.37 4.17 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.716 -0.754 . . . . 53.24 112.512 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.1 t -64.26 133.34 52.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.928 0.394 . . . . 71.03 110.882 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.03 -48.8 0.55 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.177 -0.465 . . . . 51.31 110.824 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.08 72.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.758 -0.734 . . . . 73.15 112.447 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.1 m -45.24 -59.64 2.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 74.13 110.87 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.21 84.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.114 -0.494 . . . . 73.31 110.863 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.3 p 49.5 179.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 73.23 110.928 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -140.51 -172.08 3.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 72.43 110.911 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -92.88 44.97 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.151 -0.477 . . . . 74.34 111.122 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 69.7 t -39.09 114.29 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 72.51 111.098 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 84.0 m -106.42 161.28 14.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 64.0 110.79 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -84.75 174.44 9.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.114 -0.494 . . . . 62.42 110.901 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.938 HG21 HG21 ' A' ' 120' ' ' THR . 7.6 p -104.28 96.85 4.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 52.31 111.085 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.483 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 16.1 t70 -33.47 140.35 0.24 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.563 0.697 . . . . 62.4 110.856 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.79 -36.35 10.9 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.739 2.293 . . . . 71.22 112.294 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.483 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -68.31 -25.68 65.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 74.51 110.894 -179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.784 ' CD2' HD21 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -86.64 -41.15 14.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.463 . . . . 71.23 110.903 -179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 10.5 ttmt -44.8 -42.07 7.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.181 -0.463 . . . . 75.11 110.909 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 5.4 mt-10 -72.63 -39.86 66.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.906 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 51' ' ' LEU . 4.5 m -48.59 -45.72 38.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.106 -0.497 . . . . 74.24 111.16 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.942 HD13 ' HB2' ' A' ' 121' ' ' ALA . 1.2 mt -70.33 -49.79 45.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.921 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.586 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 7.8 ttm180 -49.88 -32.82 15.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 75.0 110.823 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' ARG . 0.6 OUTLIER -85.1 -31.02 23.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.889 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.744 ' CD2' HD21 ' A' ' 92' ' ' LEU . 6.5 t80 -63.33 -43.12 98.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 65.11 110.913 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.8 mtm105 -68.69 -24.52 64.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 71.33 110.891 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.3 OUTLIER -128.05 35.43 4.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 71.11 110.938 -179.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -68.28 165.34 18.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 71.15 110.882 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.09 20.16 6.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 73.52 110.888 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -101.75 168.96 9.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 72.42 110.856 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.5 p -141.02 36.38 1.75 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 50.23 111.141 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -138.5 172.9 12.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.267 -0.424 . . . . 74.51 110.876 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -73.07 138.7 46.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.13 110.834 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.58 158.13 43.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.097 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -133.7 144.83 49.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 64.05 111.177 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.4 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.3 mt -126.99 106.84 16.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.261 -0.427 . . . . 74.25 111.083 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.516 HG23 ' HG3' ' A' ' 73' ' ' ARG . 7.3 mt -88.99 121.73 39.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 71.4 111.142 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.786 ' CE ' HG23 ' A' ' 76' ' ' VAL . 2.2 mtm -116.9 155.15 29.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.96 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -134.48 177.64 7.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 64.5 110.799 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.778 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.2 OUTLIER -128.25 118.91 49.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 72.31 111.119 179.862 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -77.46 123.32 26.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 71.15 110.922 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -14.98 62.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.279 -0.419 . . . . 73.33 110.902 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -83.05 -42.62 17.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 63.22 110.883 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -101.97 3.55 39.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.14 110.868 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 39.64 41.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 71.3 110.868 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.81 148.85 47.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 72.41 110.901 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 10.2 t -80.62 116.11 24.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 51.34 111.126 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.9 m -122.91 144.47 32.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 52.33 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 20' ' ' LEU . 2.5 tt -49.19 144.19 5.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 73.44 110.977 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HB3' HG22 ' A' ' 39' ' ' ILE . 9.3 tt0 -112.9 -42.32 3.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 51.45 110.864 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -165.69 164.34 19.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 64.55 110.909 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.4 ' CG ' HG23 ' A' ' 38' ' ' ILE . 3.6 mt-10 -148.42 112.92 5.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.447 . . . . 72.34 110.843 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' CD1' ' OE1' ' A' ' 66' ' ' GLU . 2.5 mt -120.33 128.86 53.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.44 . . . . 62.54 110.891 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.489 ' O ' HG22 ' A' ' 58' ' ' ILE . 9.9 mp0 -105.38 172.69 6.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.139 -0.482 . . . . 75.33 110.876 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 45.09 61.08 2.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.03 110.939 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.93 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -139.09 136.7 42.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.223 -0.444 . . . . 72.02 111.186 179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.502 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -78.02 169.89 18.83 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.65 0.738 . . . . 72.24 110.819 -179.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.502 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.1 Cg_endo -69.72 -5.7 16.82 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.664 2.243 . . . . 74.23 112.371 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.633 ' O ' HD23 ' A' ' 65' ' ' LEU . 3.4 mt-10 -96.18 -29.25 14.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.235 -0.438 . . . . 74.34 110.892 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -48.13 16.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.906 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -44.24 -47.09 9.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.143 -0.48 . . . . 71.43 110.935 179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.537 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -59.54 -35.5 74.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.929 179.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.633 HD23 ' O ' ' A' ' 61' ' ' GLU . 2.0 mm? -72.61 -27.61 62.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.238 -0.437 . . . . 73.03 110.898 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.498 ' OE1' ' CD1' ' A' ' 55' ' ' LEU . 5.0 mt-10 -78.04 -19.33 54.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 54.21 110.897 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.765 HD13 HH12 ' A' ' 73' ' ' ARG . 41.4 mt -81.11 154.38 72.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.659 0.742 . . . . 73.13 110.893 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' HD2' ' CZ ' ' A' ' 73' ' ' ARG . 53.0 Cg_endo -69.76 -167.8 0.24 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 2.221 . . . . 61.43 112.335 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' C ' ' HG2' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -115.77 -32.43 5.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.23 -0.441 . . . . 75.54 110.829 -179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.416 ' CD ' ' HA3' ' A' ' 101' ' ' GLY . 0.4 OUTLIER -136.51 47.04 2.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 75.12 110.842 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.471 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -142.04 101.36 5.81 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.591 0.71 . . . . 75.05 110.918 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.548 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 53.6 Cg_endo -69.82 126.49 13.32 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.607 2.205 . . . . 74.24 112.363 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.765 HH12 HD13 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -151.91 179.7 8.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 72.5 110.857 -179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.597 ' CD2' HD22 ' A' ' 117' ' ' LEU . 25.4 m-85 -103.5 149.94 24.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.139 -0.482 . . . . 75.4 110.905 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 10.7 t -151.84 128.44 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 43.23 111.154 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.786 HG23 ' CE ' ' A' ' 40' ' ' MET . 75.1 t -112.48 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 60.24 111.121 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -88.25 136.9 32.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 60.45 110.915 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 t -114.68 96.29 5.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.088 -0.505 . . . . 74.32 110.815 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.507 ' CG ' ' N ' ' A' ' 80' ' ' LYS . 81.1 t80 -81.4 166.51 20.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.488 . . . . 72.04 110.943 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.507 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 2.1 ttpm? -119.69 107.5 13.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.924 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -102.69 133.49 47.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 74.23 110.892 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 83' ' ' HIS . 21.3 t -95.42 158.5 3.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.095 -0.502 . . . . 72.34 111.168 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.475 ' N ' HG12 ' A' ' 82' ' ' VAL . 23.5 m-70 -97.39 -93.56 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 72.12 110.849 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -176.35 -52.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.233 -0.439 . . . . 71.02 110.871 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.43 -17.54 59.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 73.23 110.864 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 130.22 12.81 2.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.72 . . . . 41.21 112.462 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -103.96 142.08 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 75.33 110.804 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 2.2 p -142.35 121.46 9.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.494 . . . . 65.12 111.157 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 53.8 m -117.58 155.07 30.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.861 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.409 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 1.8 m-85 -104.14 94.72 7.02 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.676 0.751 . . . . 74.35 110.922 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.409 ' HD2' ' HA ' ' A' ' 90' ' ' TYR . 53.2 Cg_endo -69.72 98.29 0.68 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.722 2.282 . . . . 73.24 112.318 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.744 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.72 135.32 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.209 -0.45 . . . . 72.14 110.929 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.498 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 86.9 m -132.87 167.22 20.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.47 . . . . 71.23 110.857 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.627 ' CD1' HG22 ' A' ' 118' ' ' VAL . 56.7 t80 -109.02 103.37 12.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.879 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 78.1 mt -93.31 114.24 29.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.149 -0.478 . . . . 65.12 111.098 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.56 ' CD2' ' HD3' ' A' ' 114' ' ' LYS . 1.9 t80 -103.75 103.29 13.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 72.23 110.83 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.429 ' HB3' ' NH1' ' A' ' 73' ' ' ARG . 6.9 t -82.98 111.18 18.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 64.33 110.852 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.2 t -133.48 94.15 20.19 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.631 0.729 . . . . 41.22 110.85 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 -178.84 2.53 Favored 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.713 2.275 . . . . 73.5 112.302 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -103.17 -25.21 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.183 -0.462 . . . . 62.52 111.083 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.416 ' HA3' ' CD ' ' A' ' 70' ' ' ARG . . . -73.19 -18.93 79.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.753 -0.737 . . . . 62.5 112.517 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 p -58.95 -175.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.377 . . . . 62.24 110.908 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.42 152.25 41.94 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.628 0.728 . . . . 74.34 110.827 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.84 -23.34 30.53 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 74.24 112.378 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.74 62.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.439 ' O ' ' N ' ' A' ' 109' ' ' MET . 7.5 mm100 -93.58 -59.53 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.893 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -36.47 -42.95 0.36 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 70.51 110.907 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 9.4 mtm -63.8 -46.64 84.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 72.24 110.838 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.439 ' N ' ' O ' ' A' ' 106' ' ' GLN . 61.5 mtp -48.27 -32.87 7.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 65.04 110.969 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.778 ' CE2' HG12 ' A' ' 42' ' ' VAL . 25.5 m-85 -95.51 -34.94 11.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.152 -0.476 . . . . 70.32 110.876 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.99 -26.64 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.105 -0.498 . . . . 72.31 111.097 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -95.46 -24.62 15.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 64.44 112.476 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 m -97.68 -7.19 31.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.931 0.396 . . . . 71.53 110.832 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.56 ' HD3' ' CD2' ' A' ' 96' ' ' PHE . 23.7 ttpt -54.54 -60.46 3.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 65.25 110.917 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -56.04 -42.87 77.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 61.41 110.918 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -57.18 12.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.135 -0.484 . . . . 75.43 110.824 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.603 HD21 ' SD ' ' A' ' 40' ' ' MET . 17.8 tp -58.2 -58.23 9.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.03 110.909 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.627 HG22 ' CD1' ' A' ' 94' ' ' PHE . 74.1 t -47.63 -53.43 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.185 -0.462 . . . . 65.52 111.143 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.3 -35.35 50.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.919 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.938 HG21 HG21 ' A' ' 16' ' ' VAL . 4.7 m -63.97 -45.18 90.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.4 111.118 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.942 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -76.63 -23.97 53.36 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 73.35 111.103 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 70.91 40.76 0.9 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 71.51 110.9 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.479 HD13 ' CD1' ' A' ' 94' ' ' PHE . 1.0 OUTLIER -73.76 -36.46 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.893 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 6.8 m 73.33 -63.22 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 54.51 111.09 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -72.27 103.81 3.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.847 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.494 HG22 HG11 ' A' ' 118' ' ' VAL . 18.4 t -108.41 132.9 55.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.271 -0.422 . . . . 74.4 111.105 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.576 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 23.6 m-85 -127.29 160.26 31.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.44 110.896 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.38 149.87 45.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 54.34 110.903 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.532 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 12.1 pt -130.58 139.39 51.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 75.13 111.141 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 13.3 tpp180 -77.63 -13.75 59.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 63.53 110.844 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.6 t -173.69 141.86 0.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.27 -0.423 . . . . 71.14 111.18 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.418 ' C ' ' O ' ' A' ' 131' ' ' THR . 17.2 p -36.7 -44.53 0.48 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 74.33 111.163 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.415 ' O ' HG23 ' A' ' 136' ' ' THR . 2.9 m-20 -42.18 -46.94 4.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.52 110.851 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.557 ' OD1' ' CD1' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -46.05 -50.83 14.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 74.25 110.867 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.56 HD12 ' C ' ' A' ' 135' ' ' LEU . 0.9 OUTLIER -52.77 86.99 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.467 . . . . 65.44 110.929 -179.957 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 134' ' ' ASP . 5.6 p -130.5 147.81 52.24 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 50.21 111.177 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.464 ' HA ' ' CG ' ' A' ' 60' ' ' PRO . 3.8 tt0 -37.99 -40.2 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.899 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 6.3 m -75.34 -61.57 1.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 62.51 111.196 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.557 ' CD1' ' OD1' ' A' ' 134' ' ' ASP . 1.1 t90 -48.13 -19.45 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 74.15 110.966 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.833 HD13 ' N ' ' A' ' 141' ' ' LYS . 0.6 OUTLIER -89.92 -58.88 2.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.148 -0.478 . . . . 62.43 110.885 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.833 ' N ' HD13 ' A' ' 140' ' ' LEU . 0.6 OUTLIER -57.84 -28.43 64.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.34 110.917 179.814 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.93 -45.58 91.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 70.54 110.893 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.576 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 14.4 mmtt -63.12 -39.1 93.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.102 -0.499 . . . . 55.32 110.919 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.498 ' CD2' ' SG ' ' A' ' 93' ' ' CYS . 13.6 mt -70.07 -46.32 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.913 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -51.84 -173.83 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 44.32 111.155 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 17.7 t -162.65 88.47 0.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 74.54 110.818 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -116.67 -165.62 14.05 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.642 -0.789 . . . . 72.23 112.489 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 5.49 1.7 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.637 2.225 . . . . 62.34 112.313 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 53.4 p -61.01 158.95 12.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 71.54 110.898 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -121.02 155.32 34.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 71.15 110.753 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.668 -0.777 . . . . 34.42 112.444 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.482 -0.247 . . . . 55.42 112.482 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -140.58 144.35 35.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.852 0.358 . . . . 75.13 110.876 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.49 -54.69 2.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 75.2 110.853 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.39 40.43 0.8 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.67 -0.776 . . . . 73.03 112.526 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.6 m 60.39 108.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.827 0.346 . . . . 71.1 110.873 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.9 m -161.85 -45.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.472 . . . . 74.1 110.871 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -119.07 176.33 16.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.811 -0.709 . . . . 65.14 112.496 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.84 -59.92 1.95 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 64.24 110.883 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.94 42.17 0.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.116 -0.493 . . . . 72.33 110.891 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -157.57 157.13 33.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.207 -0.451 . . . . 71.31 110.891 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.1 mt -128.36 -179.79 5.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.919 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 12' ' ' VAL . 7.1 p -100.22 41.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 74.51 111.033 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.2 t -39.23 127.69 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 61.0 111.133 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 57.0 m -106.53 170.38 7.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 70.42 110.879 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.65 174.5 7.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.866 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.873 HG21 HG21 ' A' ' 120' ' ' THR . 7.1 p -105.86 97.32 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.091 -0.504 . . . . 61.51 111.177 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.517 ' CG ' HG12 ' A' ' 50' ' ' VAL . 10.2 t70 -32.63 139.69 0.21 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.543 0.687 . . . . 72.23 110.872 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 53.7 Cg_endo -69.76 -31.81 19.79 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.577 2.184 . . . . 64.15 112.38 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 20' ' ' LEU . 0.0 OUTLIER -70.58 -26.78 63.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.238 -0.437 . . . . 40.25 110.913 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.663 HD21 HD21 ' A' ' 24' ' ' LEU . 3.4 tt -85.5 -44.38 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 74.13 110.938 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 4.7 ttmt -38.41 -42.72 0.76 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 72.14 110.911 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.481 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 3.7 mt-10 -68.89 -42.92 76.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.456 . . . . 75.24 110.859 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 51' ' ' LEU . 3.3 m -48.81 -49.07 40.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 55.12 111.108 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.977 HD13 ' HB2' ' A' ' 121' ' ' ALA . 11.8 mt -65.09 -52.68 54.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 74.23 110.869 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.588 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 1.3 ttt-85 -50.86 -34.75 29.37 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.188 -0.46 . . . . 65.54 110.837 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.2 mmtt -78.6 -40.1 35.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.196 -0.456 . . . . 65.21 110.927 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.636 ' CD1' HD11 ' A' ' 38' ' ' ILE . 13.6 t80 -60.41 -35.87 76.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.16 -0.473 . . . . 71.31 110.841 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.497 ' NE ' ' O ' ' A' ' 121' ' ' ALA . 1.1 mtm105 -74.48 -23.62 58.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.43 110.898 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.588 ' CD2' ' O ' ' A' ' 25' ' ' ARG . 0.5 OUTLIER -132.56 40.47 3.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 61.1 110.907 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -76.02 173.75 10.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 65.14 110.867 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 mmmt -103.01 39.4 1.56 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 74.32 110.894 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 38.8 mm-40 -110.09 176.1 5.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 72.13 110.901 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.1 p -145.97 10.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 71.21 111.157 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -116.74 -177.55 3.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.02 110.876 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 68.4 m-20 -84.79 136.12 33.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 65.53 110.882 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -147.5 162.3 39.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 74.24 111.105 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.766 ' CB ' HD11 ' A' ' 63' ' ' LEU . . . -136.92 157.75 46.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 53.41 111.029 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.636 HD11 ' CD1' ' A' ' 27' ' ' PHE . 8.8 mt -138.39 114.05 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.132 -0.485 . . . . 64.44 111.182 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.505 HG12 HG22 ' A' ' 75' ' ' VAL . 5.2 mt -96.18 118.77 43.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.241 -0.436 . . . . 71.11 111.078 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.747 ' HE1' HG23 ' A' ' 76' ' ' VAL . 1.8 mtm -114.72 139.02 50.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.479 . . . . 63.44 110.856 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 pttt -114.2 177.68 4.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 74.52 110.918 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.714 HG12 ' CE2' ' A' ' 110' ' ' TYR . 1.4 p -132.57 106.92 11.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 64.2 111.141 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -68.46 113.9 6.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 64.22 110.886 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -58.97 -34.42 71.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.874 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.49 -35.1 79.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.32 110.947 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.417 ' O ' ' C ' ' A' ' 47' ' ' GLN . 34.6 mtp180 -105.76 3.9 29.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 71.41 110.873 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' C ' ' O ' ' A' ' 46' ' ' ARG . 2.6 mm-40 36.57 44.32 0.31 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 73.42 110.884 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 ptm -140.82 157.36 45.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.296 -0.411 . . . . 74.43 110.924 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.631 HG11 HD13 ' A' ' 117' ' ' LEU . 43.6 t -90.49 114.31 27.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 72.24 111.072 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.517 HG12 ' CG ' ' A' ' 17' ' ' ASP . 31.2 m -121.32 141.01 43.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 75.44 111.092 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.3 tp -46.65 150.04 0.74 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 72.14 110.943 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.414 ' N ' ' HG ' ' A' ' 51' ' ' LEU . 14.6 tt0 -120.31 -49.26 2.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 71.5 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -157.06 170.39 22.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.526 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -152.84 112.14 3.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 71.14 110.92 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD13 ' HG3' ' A' ' 66' ' ' GLU . 7.6 mt -112.98 130.35 56.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.906 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' C ' ' CG ' ' A' ' 57' ' ' ASN . 13.7 mp0 -109.4 162.32 14.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.882 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.438 ' CG ' ' C ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER 47.08 55.41 8.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 73.43 110.87 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.33 142.93 42.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.23 111.158 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.47 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -83.48 168.67 20.85 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.657 0.741 . . . . 64.24 110.882 -179.931 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.6 Cg_endo -69.76 1.38 4.49 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.68 2.253 . . . . 73.3 112.341 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.612 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.7 mt-10 -103.3 -27.16 12.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 65.31 110.898 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.78 -41.35 26.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 73.21 110.91 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.766 HD11 ' CB ' ' A' ' 37' ' ' ALA . 0.4 OUTLIER -53.83 -55.91 22.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 61.3 110.977 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -52.23 -29.08 21.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 73.32 110.91 179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 61' ' ' GLU . 1.4 mp -78.62 -28.84 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 72.22 110.901 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HG3' HD13 ' A' ' 55' ' ' LEU . 9.0 mm-40 -79.35 -23.8 43.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 73.55 110.892 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.932 HD22 ' HE ' ' A' ' 73' ' ' ARG . 97.0 mt -75.96 154.57 84.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.545 0.688 . . . . 70.54 110.95 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.1 Cg_endo -69.85 -163.54 0.11 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.701 2.267 . . . . 71.21 112.338 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -130.89 -30.89 1.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.253 -0.431 . . . . 74.44 110.827 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.7 mmt180 -128.27 40.74 3.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.197 -0.456 . . . . 75.43 110.823 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.13 112.71 3.31 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.553 0.692 . . . . 63.13 110.929 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.0 Cg_endo -69.78 132.07 22.53 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.692 2.261 . . . . 74.31 112.344 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.932 ' HE ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -155.24 165.04 37.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.841 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.46 ' CD2' HD22 ' A' ' 117' ' ' LEU . 44.8 m-85 -97.03 155.1 16.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 73.11 110.854 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.779 HG21 HD21 ' A' ' 67' ' ' LEU . 50.9 t -153.49 126.98 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 61.52 111.097 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.747 HG23 ' HE1' ' A' ' 40' ' ' MET . 96.8 t -111.67 95.69 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.461 . . . . 70.11 111.145 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -89.24 136.78 32.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.931 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.4 t -114.93 96.38 5.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 73.42 110.89 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.57 ' HB2' HD21 ' A' ' 140' ' ' LEU . 58.9 t80 -83.3 166.26 18.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.924 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.527 ' N ' ' CG ' ' A' ' 79' ' ' TYR . 5.2 ttpt -118.35 112.13 19.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.097 -0.501 . . . . 72.41 110.93 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -105.44 129.33 53.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 75.04 110.897 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 21.4 t -97.44 152.55 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 61.33 111.22 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -92.88 -94.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.883 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -178.54 -44.6 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.249 -0.432 . . . . 73.33 110.91 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.23 -7.52 31.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 72.34 110.922 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 117.95 13.36 7.21 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.712 -0.756 . . . . 73.01 112.479 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -109.61 133.12 53.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 75.41 110.837 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.8 p -135.84 123.93 36.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.444 . . . . 62.32 111.069 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 17.7 m -118.05 157.13 27.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.01 110.893 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 2.0 m-85 -104.81 94.59 7.66 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.693 0.759 . . . . 62.31 110.877 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.52 ' HB2' HD22 ' A' ' 144' ' ' LEU . 53.1 Cg_endo -69.84 97.46 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.659 2.24 . . . . 71.32 112.276 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.634 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.98 138.85 48.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.4 110.943 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.564 ' SG ' HD21 ' A' ' 144' ' ' LEU . 91.1 m -136.81 158.12 45.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 62.23 110.852 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.761 ' HB2' HD13 ' A' ' 123' ' ' LEU . 83.8 t80 -102.36 102.47 12.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.218 -0.446 . . . . 71.34 110.851 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.4 mt -93.02 101.96 13.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 72.41 111.115 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 98' ' ' SER . 2.5 t80 -92.84 92.9 8.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.921 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.456 ' OG ' ' NH2' ' A' ' 73' ' ' ARG . 1.5 t -80.82 109.67 15.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.198 -0.455 . . . . 74.24 110.835 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 96' ' ' PHE . 0.3 OUTLIER -133.05 96.08 18.07 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.692 0.758 . . . . 65.04 110.765 -179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.84 169.41 19.1 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.699 2.266 . . . . 63.32 112.326 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 100' ' ' VAL . 8.9 p -107.19 14.39 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 75.43 111.127 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -97.41 -16.1 35.7 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.745 -0.74 . . . . 54.2 112.526 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.456 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 2.5 t -78.97 176.99 9.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.934 0.397 . . . . 41.41 110.829 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 152.34 83.31 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.582 0.706 . . . . 61.21 110.853 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.69 -11.52 31.1 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.632 2.221 . . . . 64.41 112.417 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.85 -29.16 44.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 63.41 110.911 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.526 ' O ' ' N ' ' A' ' 109' ' ' MET . 4.6 mm100 -93.55 -56.87 2.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.893 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.432 ' C ' ' O ' ' A' ' 106' ' ' GLN . 0.0 OUTLIER -35.17 -32.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.194 -0.457 . . . . 64.41 110.911 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.474 ' N ' ' O ' ' A' ' 106' ' ' GLN . 32.5 mtm -78.34 -44.51 24.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 61.44 110.88 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.526 ' N ' ' O ' ' A' ' 106' ' ' GLN . 83.9 mtp -46.58 -34.51 5.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.428 . . . . 75.32 110.84 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.714 ' CE2' HG12 ' A' ' 42' ' ' VAL . 11.5 m-85 -93.24 -35.08 13.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.249 -0.432 . . . . 73.31 110.888 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.48 -23.44 65.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 72.32 111.079 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -99.56 -30.12 6.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.723 -0.751 . . . . 52.05 112.45 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.7 m -94.43 -8.14 39.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 74.23 110.863 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.62 ' O ' HG23 ' A' ' 118' ' ' VAL . 10.7 ttpt -50.97 -52.59 41.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.896 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -59.81 -42.36 93.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 73.23 110.877 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.412 ' NH1' ' HB2' ' A' ' 116' ' ' ARG . 0.1 OUTLIER -54.03 -56.73 15.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.962 179.942 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.631 HD13 HG11 ' A' ' 49' ' ' VAL . 11.8 tp -59.5 -58.26 9.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.156 -0.475 . . . . 73.15 110.928 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 114' ' ' LYS . 84.3 t -43.92 -53.5 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.139 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -54.45 -33.58 59.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.187 -0.461 . . . . 74.32 110.926 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.873 HG21 HG21 ' A' ' 16' ' ' VAL . 4.1 m -65.66 -44.44 86.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 64.2 111.146 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.977 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.82 -25.1 59.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 61.33 111.031 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 75.92 37.01 0.41 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.908 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.761 HD13 ' HB2' ' A' ' 94' ' ' PHE . 10.6 mt -85.21 111.25 19.66 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 71.14 110.915 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.6 t -69.94 -19.2 63.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 64.41 111.154 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -106.71 119.83 40.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.928 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 3.0 t -123.16 111.47 29.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 74.24 111.082 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 18.2 m-85 -120.24 130.07 54.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 70.4 110.894 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -113.89 137.45 51.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.54 110.882 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.55 ' CG2' ' CZ2' ' A' ' 139' ' ' TRP . 5.9 pt -117.7 115.78 49.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.135 -0.484 . . . . 60.42 111.123 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -52.38 -30.89 31.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 74.34 110.887 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.2 t -152.9 147.58 26.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.1 111.197 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.483 HG23 HH22 ' A' ' 73' ' ' ARG . 17.4 p -45.15 -49.28 12.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 74.22 111.189 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.6 OUTLIER -37.34 -29.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.156 -0.475 . . . . 71.44 110.845 179.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 136' ' ' THR . 4.7 t0 -65.77 -47.14 76.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 72.4 110.856 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.661 HD21 ' HB3' ' A' ' 63' ' ' LEU . 3.1 tp -52.13 85.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 63.04 110.899 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.492 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -126.45 146.47 50.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.203 -0.453 . . . . 45.43 111.103 -179.986 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -42.76 -45.7 4.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 63.01 110.883 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 26.7 m -68.59 -61.7 1.71 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.104 -0.498 . . . . 75.51 111.153 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.55 ' CZ2' ' CG2' ' A' ' 129' ' ' ILE . 16.0 t90 -43.28 -24.81 0.1 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.185 -0.461 . . . . 74.33 110.891 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.57 HD21 ' HB2' ' A' ' 79' ' ' TYR . 3.6 tp -83.82 -62.18 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 73.33 110.918 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.74 -19.99 7.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.163 -0.471 . . . . 71.13 110.921 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.15 -56.53 12.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 71.41 110.822 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 127' ' ' PHE . 12.7 mmtt -59.12 -40.92 86.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.46 . . . . 71.11 110.94 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.564 HD21 ' SG ' ' A' ' 93' ' ' CYS . 18.7 mt -66.18 -49.12 68.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 73.3 110.976 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.74 -65.84 0.26 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 75.3 111.1 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 65.1 m -116.31 44.86 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.837 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 45.12 -155.01 0.42 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.734 -0.746 . . . . 53.43 112.496 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 117.53 5.14 Favored 'Trans proline' 0 C--O 1.23 0.11 0 C-N-CA 122.72 2.28 . . . . 72.21 112.318 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 3.7 m -104.42 -48.81 3.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 63.01 110.847 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 35.6 t -87.15 86.03 7.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.49 . . . . 62.45 110.816 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.41 0 C-N-CA 120.783 -0.723 . . . . 61.14 112.537 -179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.465 -0.254 . . . . 61.45 112.465 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 t -130.66 127.75 39.55 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.865 0.364 . . . . 72.2 110.88 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.92 118.82 21.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 53.01 110.831 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.84 82.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.758 -0.734 . . . . 73.4 112.522 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.8 t -153.2 149.37 27.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.876 0.369 . . . . 52.21 110.829 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.08 170.9 15.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 63.32 110.786 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.57 83.51 0.72 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.787 -0.72 . . . . 60.54 112.471 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -85.96 154.07 21.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 73.13 110.809 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -134.67 89.11 2.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.076 -0.511 . . . . 64.35 110.905 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.4 t 55.42 164.7 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.223 -0.444 . . . . 51.01 110.869 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.4 mt -138.46 -171.55 3.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 75.41 110.962 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.549 ' O ' HG13 ' A' ' 12' ' ' VAL . 9.0 p -104.8 45.58 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.245 -0.434 . . . . 73.34 111.202 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -39.01 132.35 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 73.25 111.092 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.2 m -114.42 158.62 21.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.14 -0.482 . . . . 73.12 110.897 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.45 173.25 10.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.195 -0.457 . . . . 64.53 110.916 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.049 HG21 HG21 ' A' ' 120' ' ' THR . 2.1 p -101.7 98.36 6.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.186 -0.461 . . . . 75.21 111.123 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.533 ' CG ' HG12 ' A' ' 50' ' ' VAL . 11.2 t70 -33.5 140.18 0.24 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.623 0.725 . . . . 71.32 110.871 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 54.1 Cg_endo -69.82 -37.05 9.54 Favored 'Trans proline' 0 N--CA 1.465 -0.151 0 C-N-CA 122.705 2.27 . . . . 64.21 112.352 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.49 ' CG ' ' OD2' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -67.07 -26.82 66.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.227 -0.442 . . . . 75.5 110.908 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD12 ' N ' ' A' ' 51' ' ' LEU . 2.1 tt -86.48 -47.94 8.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 74.14 110.902 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 20' ' ' LEU . 3.3 ttmt -35.7 -43.24 0.28 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.211 -0.449 . . . . 61.11 110.846 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.418 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 9.8 mt-10 -68.34 -43.36 77.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 73.34 110.843 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.489 ' N ' ' O ' ' A' ' 20' ' ' LEU . 3.7 m -47.71 -39.15 16.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.124 -0.489 . . . . 73.01 111.157 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.061 HD13 ' HB2' ' A' ' 121' ' ' ALA . 16.0 mt -74.2 -52.05 13.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 75.05 110.903 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' O ' ' CD2' ' A' ' 29' ' ' PHE . 10.8 ttp-105 -50.67 -32.3 18.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 65.41 110.859 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -40.51 16.47 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.153 -0.476 . . . . 72.44 110.932 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.882 ' CD1' HD11 ' A' ' 38' ' ' ILE . 9.0 t80 -56.99 -22.67 40.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 73.21 110.902 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 1.1 mtm-85 -88.17 -33.35 18.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.496 . . . . 75.3 110.872 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -116.12 32.62 6.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.13 110.892 -179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.547 ' HD3' ' CD1' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -87.34 -175.72 5.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.913 -179.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.763 ' O ' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -66.26 -16.1 63.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 53.22 110.913 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 30' ' ' ARG . 27.1 mt-10 34.87 -136.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 74.02 110.888 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.763 HG23 ' O ' ' A' ' 31' ' ' LYS . 4.5 p 59.51 10.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.477 . . . . 71.35 111.114 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 34' ' ' ASN . 0.8 OUTLIER -152.59 118.55 5.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 65.03 110.902 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -50.77 118.88 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 41.23 110.851 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -136.16 162.96 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 63.54 111.12 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.699 ' HB1' HD11 ' A' ' 63' ' ' LEU . . . -141.45 139.1 33.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.251 -0.431 . . . . 73.1 111.124 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.882 HD11 ' CD1' ' A' ' 27' ' ' PHE . 19.3 mt -121.23 109.13 24.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 74.2 111.06 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.468 HG23 HG22 ' A' ' 75' ' ' VAL . 2.7 mt -91.43 117.68 35.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 54.41 111.099 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.812 ' CE ' HG23 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -113.08 150.07 32.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.085 -0.507 . . . . 63.1 110.921 179.791 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 pttt -127.72 177.59 6.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 54.2 110.897 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.844 HG12 ' CE2' ' A' ' 110' ' ' TYR . 0.4 OUTLIER -129.57 118.67 45.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 41.53 111.125 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -80.63 120.35 24.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 71.52 110.821 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.04 -20.51 64.99 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 63.13 110.927 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -75.26 -39.65 59.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 75.41 110.879 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.441 ' O ' ' C ' ' A' ' 47' ' ' GLN . 17.9 mtp180 -107.6 9.52 29.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 71.33 110.861 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 46' ' ' ARG . 1.2 mm-40 34.31 53.14 0.55 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 74.2 110.86 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.3 ptm -146.85 154.77 41.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.854 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 5.1 t -88.75 112.01 23.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 71.52 111.081 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.533 HG12 ' CG ' ' A' ' 17' ' ' ASP . 27.7 m -118.29 143.83 28.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 53.32 111.109 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.682 ' N ' HD12 ' A' ' 20' ' ' LEU . 3.1 tt -52.45 139.82 24.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.921 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -107.96 -40.11 5.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 73.32 110.872 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -162.2 168.61 22.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.868 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.486 ' CG ' HG23 ' A' ' 38' ' ' ILE . 6.2 mt-10 -151.53 110.65 3.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 74.01 110.896 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.586 HD13 ' HG3' ' A' ' 66' ' ' GLU . 1.5 mt -111.52 141.23 45.36 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.213 -0.449 . . . . 54.21 110.891 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' O ' HG22 ' A' ' 58' ' ' ILE . 7.8 mp0 -121.01 162.68 19.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 71.11 110.889 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 57' ' ' ASN . 0.0 OUTLIER 44.21 52.6 7.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 74.41 110.911 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.97 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -126.89 139.84 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 70.03 111.123 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.4 OUTLIER -80.87 167.45 32.32 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.754 0.787 . . . . 72.43 110.81 -179.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 54.3 Cg_endo -69.75 3.79 2.56 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.674 2.25 . . . . 64.23 112.317 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -102.61 -28.52 12.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.32 110.907 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -81.68 -41.86 20.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 74.33 110.873 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.699 HD11 ' HB1' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -53.56 -57.72 9.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 72.45 110.917 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -26.0 0.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 71.43 110.929 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 40.7 mt -85.04 -33.99 22.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.875 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.586 ' HG3' HD13 ' A' ' 55' ' ' LEU . 28.2 mm-40 -68.29 -22.14 64.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.281 -0.418 . . . . 41.32 110.871 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.491 HD13 ' OG ' ' A' ' 97' ' ' SER . 28.9 mt -86.42 152.61 55.25 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.554 0.692 . . . . 63.33 110.952 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.485 ' HD2' ' NE ' ' A' ' 73' ' ' ARG . 53.6 Cg_endo -69.78 -163.46 0.11 Allowed 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.683 2.256 . . . . 42.11 112.341 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' CG ' ' HG2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -132.5 -30.8 1.43 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 64.23 110.914 -179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' ' CG ' ' A' ' 69' ' ' GLU . 30.9 mmt-85 -122.38 35.49 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.11 110.897 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -147.8 118.2 4.37 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.568 0.699 . . . . 74.22 110.973 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.581 ' HG2' ' CE1' ' A' ' 110' ' ' TYR . 54.3 Cg_endo -69.75 132.59 23.67 Favored 'Trans proline' 0 C--O 1.231 0.169 0 C-N-CA 122.649 2.233 . . . . 52.54 112.424 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.515 HH22 HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -156.36 158.22 37.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 71.22 110.861 -179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.543 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 28.3 m-85 -98.03 155.4 17.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 74.0 110.898 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.468 HG22 HG23 ' A' ' 39' ' ' ILE . 6.2 t -153.28 137.66 9.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 61.14 111.129 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.812 HG23 ' CE ' ' A' ' 40' ' ' MET . 82.3 t -118.94 99.29 7.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.062 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.436 ' HD2' HD22 ' A' ' 140' ' ' LEU . 10.3 t80 -91.59 135.01 34.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 74.23 110.958 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -116.55 96.13 5.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 72.23 110.804 -179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.594 ' HB2' HD21 ' A' ' 140' ' ' LEU . 79.2 t80 -85.89 154.56 21.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 70.24 110.914 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.505 ' CE ' HG21 ' A' ' 88' ' ' VAL . 21.5 tttt -105.49 106.45 16.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 55.31 110.982 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.51 129.43 45.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 74.24 110.877 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.576 HG12 ' N ' ' A' ' 83' ' ' HIS . 26.2 t -98.91 164.09 2.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.066 -0.516 . . . . 73.54 111.059 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.576 ' N ' HG12 ' A' ' 82' ' ' VAL . 33.2 m-70 -102.89 -91.86 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.125 -0.489 . . . . 73.35 110.867 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 176.09 -46.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 73.24 110.835 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.94 -9.12 42.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.155 -0.475 . . . . 42.23 110.889 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 121.7 13.59 5.06 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.76 -0.733 . . . . 60.33 112.519 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -110.18 139.97 44.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 74.52 110.835 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.505 HG21 ' CE ' ' A' ' 80' ' ' LYS . 4.0 p -139.53 129.44 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.151 -0.477 . . . . 73.51 111.089 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 18.5 m -125.33 149.87 47.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.181 -0.463 . . . . 62.2 110.836 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.725 ' OH ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -105.66 93.29 7.07 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.727 0.775 . . . . 53.23 110.904 -179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.471 ' HG2' HD13 ' A' ' 144' ' ' LEU . 54.0 Cg_endo -69.77 96.47 0.59 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.673 2.249 . . . . 73.12 112.318 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.705 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -71.78 137.31 47.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.25 110.891 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.459 ' SG ' ' CD2' ' A' ' 144' ' ' LEU . 73.8 m -137.93 156.37 47.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.139 -0.482 . . . . 51.41 110.879 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.791 ' HB2' HD13 ' A' ' 123' ' ' LEU . 88.5 t80 -101.14 105.17 16.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 62.35 110.898 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 69.1 mt -92.4 101.25 12.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.124 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.3 t80 -79.67 96.26 6.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 72.42 110.906 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.602 ' OG ' HD11 ' A' ' 129' ' ' ILE . 0.3 OUTLIER -77.93 103.74 8.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.139 -0.482 . . . . 71.52 110.798 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 96' ' ' PHE . 4.9 p -134.83 106.26 10.62 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.636 0.731 . . . . 74.25 110.823 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 98' ' ' SER . 53.3 Cg_endo -69.75 -166.79 0.2 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.714 2.276 . . . . 74.24 112.339 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -122.6 -24.37 2.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 51.13 111.142 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.37 -17.81 80.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.754 -0.736 . . . . 63.14 112.44 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . 0.442 ' CB ' ' HD3' ' A' ' 72' ' ' PRO . 5.0 p -57.9 -177.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.808 0.337 . . . . 74.24 110.923 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.05 150.45 37.09 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.563 0.697 . . . . 73.32 110.902 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.78 -10.49 28.68 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.631 2.221 . . . . 64.32 112.336 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -77.79 -35.2 51.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 54.32 110.894 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' A' ' 109' ' ' MET . 5.2 mm100 -91.7 -54.44 3.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 62.23 110.931 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -39.03 0.7 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 44.13 110.942 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 4.6 mtm -63.65 -39.67 94.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 72.15 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 106' ' ' GLN . 67.8 mtp -56.12 -38.96 71.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.844 ' CE2' HG12 ' A' ' 42' ' ' VAL . 28.6 m-85 -84.64 -41.26 16.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 71.33 110.903 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.6 -27.92 68.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.475 . . . . 74.3 111.107 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -97.18 -23.97 13.66 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.735 -0.745 . . . . 61.14 112.463 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -100.41 -7.03 24.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.911 0.386 . . . . 72.21 110.839 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 110' ' ' TYR . 22.4 ttpt -54.68 -66.03 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 73.23 110.835 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -47.83 -32.36 6.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.181 -0.463 . . . . 73.44 110.845 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.5 tpp180 -70.59 -51.37 28.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 65.45 110.9 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.612 ' C ' HD13 ' A' ' 117' ' ' LEU . 3.3 tm? -62.99 -46.11 89.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 70.45 110.931 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.657 HG22 ' CD2' ' A' ' 94' ' ' PHE . 54.3 t -61.99 -51.85 67.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 73.43 111.171 179.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -51.54 -38.09 52.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.04 110.851 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 1.049 HG21 HG21 ' A' ' 16' ' ' VAL . 6.2 m -62.21 -42.97 99.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 72.31 111.17 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.061 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -74.05 -20.57 60.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 71.2 111.06 179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 71.71 32.41 1.97 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.212 -0.449 . . . . 73.43 110.841 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 94' ' ' PHE . 5.4 mt -86.45 87.77 7.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.451 . . . . 64.22 110.903 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.5 m -52.44 -31.62 35.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 43.42 111.146 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -97.01 96.02 8.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.932 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.697 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.6 OUTLIER -118.56 121.56 67.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.116 179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -113.17 161.07 17.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 73.41 110.889 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -129.05 122.95 31.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 75.12 110.935 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.602 HD11 ' OG ' ' A' ' 97' ' ' SER . 11.5 pt -100.22 131.61 47.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 71.54 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -74.53 -15.97 60.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.105 -0.498 . . . . 75.13 110.872 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.439 ' O ' ' C ' ' A' ' 132' ' ' THR . 1.8 t -171.61 141.95 1.54 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 73.23 111.171 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 HH22 ' A' ' 73' ' ' ARG . 20.9 p -34.3 -51.43 0.45 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 53.3 111.155 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.431 ' C ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -36.02 -47.7 0.55 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.209 -0.451 . . . . 71.43 110.932 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.442 ' OD1' ' NE1' ' A' ' 139' ' ' TRP . 0.3 OUTLIER -45.83 -49.38 15.31 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.891 179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.444 HD12 ' C ' ' A' ' 135' ' ' LEU . 1.7 tp -54.53 87.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.239 -0.437 . . . . 73.42 110.912 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.7 OUTLIER -129.7 143.87 51.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 61.25 111.18 179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -39.29 -46.99 1.64 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 73.11 110.937 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 140' ' ' LEU . 11.4 m -69.64 -61.26 1.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.092 -0.504 . . . . 65.33 111.155 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.442 ' NE1' ' OD1' ' A' ' 134' ' ' ASP . 26.6 t90 -42.49 -23.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 72.24 110.982 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.594 HD21 ' HB2' ' A' ' 79' ' ' TYR . 10.1 tp -86.45 -66.8 0.87 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 74.33 110.918 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.94 -17.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 64.35 110.879 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -69.46 -55.57 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.89 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 13.7 mmtt -59.17 -37.66 77.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.911 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' A' ' 91' ' ' PRO . 13.6 mt -71.71 -45.96 60.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 73.03 110.906 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.406 ' C ' ' O ' ' A' ' 144' ' ' LEU . . . -36.1 -71.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.467 . . . . 71.24 111.125 179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.12 37.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 71.2 110.854 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -50.9 162.68 1.1 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.702 -0.761 . . . . 72.01 112.546 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.68 107.82 1.93 Allowed 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.728 2.285 . . . . 75.12 112.362 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 94.5 p -133.05 132.0 41.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.248 -0.433 . . . . 74.23 110.885 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 97.6 p -122.32 106.36 11.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 65.24 110.841 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 C-N-CA 120.761 -0.733 . . . . 40.34 112.463 179.95 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.435 -0.266 . . . . 74.13 112.435 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 -48.59 1.19 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.845 0.355 . . . . 62.41 110.846 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -87.17 126.93 35.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 70.25 110.838 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.23 -113.98 1.39 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.701 -0.761 . . . . 62.11 112.484 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 80.1 p -101.09 177.33 4.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.968 0.413 . . . . 74.51 110.811 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -175.65 171.58 2.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 73.45 110.879 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -168.45 -154.51 8.9 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.775 -0.726 . . . . 64.13 112.48 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.84 177.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.812 0.339 . . . . 55.35 110.893 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -96.5 80.07 3.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 72.45 110.861 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -175.87 127.38 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 74.23 110.88 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.431 HD23 ' SD ' ' A' ' 108' ' ' MET . 9.5 mt -138.18 -177.52 4.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 72.42 110.941 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 12' ' ' VAL . 9.5 t -89.36 35.97 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 53.23 111.149 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' C ' ' O ' ' A' ' 12' ' ' VAL . 7.4 p -36.47 134.73 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 53.22 111.114 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 1.01 ' SG ' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -117.85 -171.91 2.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.173 -0.467 . . . . 72.11 110.901 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -122.13 141.62 51.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.224 -0.444 . . . . 75.33 110.913 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.948 HG21 ' CG2' ' A' ' 120' ' ' THR . 3.2 p -67.61 93.61 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 60.14 111.133 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.496 ' OD1' ' CG ' ' A' ' 19' ' ' GLU . 15.1 t70 -33.9 140.07 0.26 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.594 0.711 . . . . 41.51 110.856 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' CG ' ' A' ' 17' ' ' ASP . 52.8 Cg_endo -69.81 -29.72 23.17 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.625 2.216 . . . . 53.15 112.313 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.496 ' CG ' ' OD1' ' A' ' 17' ' ' ASP . 0.0 OUTLIER -72.25 -26.84 62.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.919 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.783 HD11 ' HG2' ' A' ' 40' ' ' MET . 2.2 tt -89.69 -47.89 7.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.131 -0.486 . . . . 54.22 110.868 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.482 ' HG3' ' CG2' ' A' ' 120' ' ' THR . 3.5 ttmt -34.14 -46.37 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.452 . . . . 61.53 110.848 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' CG ' ' A' ' 26' ' ' LYS . 11.2 mt-10 -64.09 -46.6 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 64.15 110.865 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.464 ' N ' ' O ' ' A' ' 20' ' ' LEU . 4.0 m -47.11 -43.25 20.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.137 -0.483 . . . . 62.33 111.121 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.127 HD13 ' HB2' ' A' ' 121' ' ' ALA . 29.9 mt -66.07 -53.2 41.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 72.4 110.922 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -54.29 -30.6 51.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.473 . . . . 74.33 110.913 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' CG ' ' O ' ' A' ' 22' ' ' GLU . 1.1 mttt -82.26 -36.27 27.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.137 -0.483 . . . . 71.3 110.891 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.768 ' CD2' HD21 ' A' ' 92' ' ' LEU . 4.3 t80 -59.25 -35.46 73.74 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.848 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.554 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 6.3 mtm180 -72.06 -32.02 66.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 73.33 110.937 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.554 ' CE1' ' HB2' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -126.49 45.69 2.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 74.14 110.862 -179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -86.82 175.85 8.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 74.33 110.914 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.6 mmtt -112.48 37.91 2.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.254 -0.43 . . . . 73.14 110.879 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 30' ' ' ARG . 9.7 mm-40 -100.59 -44.03 5.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.447 . . . . 51.34 110.913 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.1 p 46.72 34.26 2.46 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.121 -0.49 . . . . 74.3 111.155 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.593 ' ND2' ' H ' ' A' ' 57' ' ' ASN . 0.5 OUTLIER -140.2 134.27 30.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.274 -0.421 . . . . 63.42 110.931 -179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 34' ' ' ASN . 31.0 m-20 -36.79 117.52 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.472 . . . . 52.14 110.855 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -144.7 163.91 32.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.158 -0.473 . . . . 71.13 111.116 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -138.57 155.34 48.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.444 . . . . 41.2 111.06 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.776 HG23 ' CG ' ' A' ' 54' ' ' GLU . 8.7 mt -136.84 101.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.441 . . . . 75.53 111.115 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.519 HG23 HG22 ' A' ' 75' ' ' VAL . 4.2 mt -87.05 115.52 27.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.188 -0.46 . . . . 61.41 111.088 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.783 ' HG2' HD11 ' A' ' 20' ' ' LEU . 1.2 mtm -109.54 142.75 40.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 41.34 110.86 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -113.59 177.81 4.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.456 . . . . 74.43 110.919 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.89 HG12 ' CE2' ' A' ' 110' ' ' TYR . 2.0 p -131.37 102.25 5.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 52.45 111.133 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.35 114.36 3.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.496 . . . . 71.15 110.874 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.535 ' HB2' ' HE1' ' A' ' 109' ' ' MET . 2.5 tmtt? -65.84 -17.44 64.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.958 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.24 -34.86 28.65 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 73.13 110.87 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -105.42 -3.41 22.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 75.33 110.822 -179.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 44.19 51.1 7.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.33 110.932 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 4.4 ptm -148.72 138.58 22.15 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.943 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 1.01 HG23 ' SG ' ' A' ' 14' ' ' CYS . 19.3 t -74.71 105.78 4.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.262 -0.426 . . . . 42.43 111.137 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.416 HG12 ' CG ' ' A' ' 17' ' ' ASP . 35.6 m -115.83 143.67 25.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 73.24 111.136 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.662 ' N ' HD12 ' A' ' 20' ' ' LEU . 16.0 tp -48.35 154.74 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 63.1 110.891 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -129.12 -37.05 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 71.41 110.912 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -162.52 162.08 27.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 62.34 110.876 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.776 ' CG ' HG23 ' A' ' 38' ' ' ILE . 5.4 mt-10 -149.96 106.26 3.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.199 -0.455 . . . . 74.44 110.872 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.2 mt -104.68 139.78 39.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 64.53 110.913 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.7 mp0 -118.68 153.57 34.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.848 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.593 ' H ' ' ND2' ' A' ' 34' ' ' ASN . 4.5 m-80 53.96 54.45 9.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.885 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.957 ' O ' HD13 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -129.2 139.3 52.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 73.01 111.148 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.476 ' CB ' ' HD2' ' A' ' 60' ' ' PRO . 0.6 OUTLIER -81.83 169.14 19.73 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.648 0.737 . . . . 73.13 110.831 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.476 ' HD2' ' CB ' ' A' ' 59' ' ' SER . 53.3 Cg_endo -69.72 1.46 4.39 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.63 2.22 . . . . 74.33 112.367 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.2 mt-10 -100.48 -26.98 13.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 64.2 110.796 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -41.5 18.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.02 110.921 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.629 ' HB3' HD21 ' A' ' 135' ' ' LEU . 0.0 OUTLIER -52.66 -50.32 63.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.178 -0.464 . . . . 63.13 110.899 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HG2' ' CD1' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.8 -35.06 60.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.241 -0.436 . . . . 73.23 110.839 179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' CD1' ' HG2' ' A' ' 64' ' ' LYS . 2.8 mp -70.78 -35.1 72.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.283 -0.417 . . . . 72.45 110.904 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -68.08 -32.6 73.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 71.03 110.906 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.566 HD21 HG21 ' A' ' 75' ' ' VAL . 80.3 mt -69.22 152.29 96.68 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.616 0.722 . . . . 74.25 110.892 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.487 ' CG ' ' HB2' ' A' ' 71' ' ' GLN . 53.0 Cg_endo -69.85 -164.5 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.698 2.265 . . . . 70.52 112.292 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -116.18 -22.88 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 73.34 110.915 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HA ' ' CG ' ' A' ' 99' ' ' PRO . 0.9 OUTLIER -150.95 50.11 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 73.22 110.901 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.487 ' HB2' ' CG ' ' A' ' 68' ' ' PRO . 5.8 mt-30 -142.0 110.18 6.02 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.62 0.724 . . . . 73.44 110.953 -179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.522 ' O ' ' CZ ' ' A' ' 110' ' ' TYR . 54.1 Cg_endo -69.7 135.18 29.93 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.691 2.261 . . . . 75.52 112.393 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' HA ' ' CE2' ' A' ' 110' ' ' TYR . 17.1 ptp180 -162.42 176.96 9.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.89 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 110' ' ' TYR . 33.2 m-85 -109.41 150.71 27.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.864 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.566 HG21 HD21 ' A' ' 67' ' ' LEU . 22.0 t -152.79 137.52 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 71.43 111.149 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.626 HG23 ' HE1' ' A' ' 40' ' ' MET . 40.6 t -117.56 96.28 4.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 74.4 111.104 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.486 ' HB2' HD12 ' A' ' 95' ' ' ILE . 9.7 t80 -92.5 132.93 36.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 73.41 110.965 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.2 t -113.29 97.23 6.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.473 . . . . 62.23 110.866 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.631 ' HB2' HD21 ' A' ' 140' ' ' LEU . 53.3 t80 -83.68 160.83 21.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 74.34 110.915 -179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.531 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 5.7 ttpt -111.26 111.27 22.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 73.44 110.86 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.77 130.67 52.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.129 -0.487 . . . . 63.34 110.981 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.438 HG12 ' N ' ' A' ' 83' ' ' HIS . 28.3 t -97.92 155.47 3.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 74.44 111.135 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.438 ' N ' HG12 ' A' ' 82' ' ' VAL . 16.8 m-70 -92.35 -86.18 0.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 54.05 110.885 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.424 ' CB ' ' O ' ' A' ' 83' ' ' HIS . 0.6 OUTLIER 166.38 -35.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 72.34 110.818 179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -77.66 -12.69 59.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.33 110.843 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 126.78 13.57 3.0 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.515 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.418 ' O ' ' CD2' ' A' ' 83' ' ' HIS . 20.7 mmt85 -116.04 135.37 54.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.766 0.317 . . . . 74.14 110.862 -179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.6 p -133.41 124.62 49.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 64.14 111.122 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 9.7 m -118.35 151.33 37.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.802 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.531 ' CD1' ' HG3' ' A' ' 80' ' ' LYS . 0.6 OUTLIER -104.13 94.66 6.95 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.673 0.749 . . . . 73.13 110.911 -179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.647 ' CG ' HD13 ' A' ' 144' ' ' LEU . 53.0 Cg_endo -69.78 99.53 0.76 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.697 2.264 . . . . 71.22 112.35 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.768 HD21 ' CD2' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -71.87 135.59 46.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.411 . . . . 74.34 110.933 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' CYS . . . . . 0.438 ' SG ' ' CE2' ' A' ' 127' ' ' PHE . 72.6 m -134.61 162.93 30.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.163 -0.472 . . . . 61.03 110.91 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' PHE . . . . . 0.63 ' CE1' HD12 ' A' ' 117' ' ' LEU . 71.1 t80 -108.76 107.29 17.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 72.33 110.901 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.486 HD12 ' HB2' ' A' ' 77' ' ' TYR . 75.2 mt -93.56 119.52 41.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.113 -0.494 . . . . 51.34 111.12 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.43 ' CD1' ' C ' ' A' ' 96' ' ' PHE . 1.0 OUTLIER -99.68 105.46 17.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 75.03 110.919 179.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.1 t -78.73 99.02 6.46 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.11 -0.495 . . . . 50.14 110.888 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 4.4 t -132.11 93.91 25.32 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.676 0.751 . . . . 72.42 110.873 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.44 ' CG ' ' HA ' ' A' ' 70' ' ' ARG . 54.0 Cg_endo -69.7 -169.31 0.32 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.757 2.305 . . . . 61.35 112.333 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 5.3 p -103.59 -26.74 3.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 74.21 111.104 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.13 -6.54 87.6 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.677 -0.773 . . . . 63.52 112.508 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 12.3 p -61.61 167.64 3.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 74.02 110.872 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.63 153.4 39.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.662 0.744 . . . . 65.35 110.894 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -17.64 37.64 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.787 2.325 . . . . 75.35 112.303 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -75.5 -38.93 59.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 63.41 110.901 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -86.48 -50.22 7.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 65.14 110.952 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.91 -34.48 20.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 73.23 110.846 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.431 ' SD ' HD23 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -67.5 -28.99 68.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.266 -0.424 . . . . 65.03 110.811 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.535 ' HE1' ' HB2' ' A' ' 44' ' ' LYS . 74.5 mtp -65.24 -37.39 87.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.263 -0.426 . . . . 70.0 110.907 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.89 ' CE2' HG12 ' A' ' 42' ' ' VAL . 12.0 m-85 -89.45 -41.64 11.96 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 72.25 110.918 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.13 -22.73 52.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 74.1 111.12 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.41 9.47 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.756 -0.735 . . . . 43.34 112.545 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -107.24 3.78 25.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.929 0.395 . . . . 72.02 110.835 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 110' ' ' TYR . 16.5 ttpt -58.36 -67.36 0.36 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 70.33 110.926 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 25.0 m-20 -46.54 -40.58 12.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.0 110.908 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 16.5 tpt180 -59.76 -50.58 73.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 75.1 110.834 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.63 HD12 ' CE1' ' A' ' 94' ' ' PHE . 3.4 tm? -63.18 -54.71 33.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 73.43 110.901 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.601 HG22 ' CG ' ' A' ' 94' ' ' PHE . 53.7 t -55.33 -53.48 35.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.451 . . . . 73.0 111.087 179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.6 mm-40 -50.32 -36.88 33.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 63.15 110.943 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.948 ' CG2' HG21 ' A' ' 16' ' ' VAL . 18.6 m -64.8 -43.71 92.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.184 -0.462 . . . . 64.01 111.168 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 1.127 ' HB2' HD13 ' A' ' 24' ' ' LEU . . . -73.67 -18.52 61.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 61.33 111.084 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 69.69 44.01 0.92 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 72.24 110.881 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.469 HD13 ' HB2' ' A' ' 94' ' ' PHE . 8.6 mt -100.81 89.64 3.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 73.12 110.847 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.5 t -56.93 -23.6 46.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.45 111.137 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -104.74 96.67 6.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 71.4 110.887 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.627 HG23 ' HD2' ' A' ' 94' ' ' PHE . 0.5 OUTLIER -120.27 105.0 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 75.03 111.172 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 143' ' ' LYS . 1.5 m-85 -92.92 164.78 13.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 61.53 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -128.5 139.82 52.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 75.15 110.967 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.515 HG22 ' HB3' ' A' ' 134' ' ' ASP . 6.5 pt -121.0 123.51 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 74.43 111.092 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 9.0 tpp180 -69.27 -26.34 64.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.493 . . . . 64.45 110.877 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 132' ' ' THR . 3.6 t -156.99 140.44 15.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 42.01 111.14 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.427 ' C ' ' O ' ' A' ' 131' ' ' THR . 22.2 p -35.68 -44.49 0.33 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 71.3 111.202 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -43.3 -48.38 6.79 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.189 -0.459 . . . . 74.32 110.831 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.515 ' HB3' HG22 ' A' ' 129' ' ' ILE . 1.0 OUTLIER -45.45 -47.6 13.85 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.168 -0.469 . . . . 61.14 110.845 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.629 HD21 ' HB3' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -53.29 85.37 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 73.0 110.891 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.474 ' N ' ' O ' ' A' ' 134' ' ' ASP . 0.8 OUTLIER -127.24 151.97 48.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 72.22 111.114 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -48.31 -37.99 17.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.904 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 32.8 m -74.83 -64.07 1.12 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 54.24 111.128 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' TRP . . . . . 0.54 ' CE2' ' HE2' ' A' ' 143' ' ' LYS . 6.6 t90 -39.4 -37.02 0.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 72.11 110.869 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.631 HD21 ' HB2' ' A' ' 79' ' ' TYR . 1.8 tp -74.29 -66.4 0.73 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.32 -0.4 . . . . 72.14 110.92 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 mtpm? -47.57 -19.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 65.52 110.931 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -64.89 -57.03 9.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 64.45 110.893 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.54 ' HE2' ' CE2' ' A' ' 139' ' ' TRP . 0.2 OUTLIER -52.25 -36.66 53.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 63.21 110.91 179.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.647 HD13 ' CG ' ' A' ' 91' ' ' PRO . 1.7 mt -75.63 -45.7 35.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.211 -0.45 . . . . 75.13 110.908 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -47.59 -84.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 61.3 111.118 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 10.6 t -163.61 54.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 72.44 110.846 -179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -84.33 -156.63 24.73 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.702 -0.761 . . . . 52.34 112.457 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 6.59 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.609 2.206 . . . . 71.34 112.34 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 98.2 p -38.75 -46.02 1.2 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 73.42 110.888 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 1.9 t -41.47 159.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.159 -0.473 . . . . 70.52 110.841 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.717 -0.754 . . . . 53.34 112.464 -179.974 . . . . . . . . 0 0 . 1 stop_ save_