data_5j7j_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 5j7j _Structure_validation_residue.Date_analyzed 2017-10-20 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 ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.423 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.44 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.423 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.461 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.422 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.663 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.663 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HB2' ' CB ' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.653 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.653 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.485 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.528 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.528 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.494 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.402 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.517 ' O ' HG22 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.536 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.663 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.663 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.502 ' O ' HG21 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.502 HG21 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.452 ' CD2' ' HB3' ' A' ' 120' ' ' GLU . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.557 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.628 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.557 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.434 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.586 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.717 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.617 ' HE3' ' CE2' ' B' ' 12' ' ' TYR . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.469 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . 0.576 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' LEU . . . . . 0.485 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' CYS . . . . . 0.576 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.717 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.488 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.448 ' CD ' ' HZ3' ' B' ' 10' ' ' LYS . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.614 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.438 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.528 HD13 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.631 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.483 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.631 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.484 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.483 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.48 HD13 ' SG ' ' B' ' 3' ' ' CYS . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.61 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.614 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.52 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HZ3' ' HB3' ' A' ' 84' ' ' GLU . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.412 HD12 HG22 ' A' ' 85' ' ' ILE . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.477 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.56 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.56 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.433 ' CD2' HD22 ' A' ' 111' ' ' ASN . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.433 HD22 ' CD2' ' A' ' 107' ' ' HIS . 89.5 m-20 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.514 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 115' ' ' LYS . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.4 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.4 ' HB2' ' N ' ' A' ' 117' ' ' THR . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.542 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.519 ' SD ' ' CE1' ' B' ' 12' ' ' TYR . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.445 ' CG ' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 142' ' ' VAL . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.494 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 138' ' ' TYR . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . 0.528 ' CB ' HD13 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' CYS . . . . . 0.52 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' LYS . . . . . 0.448 ' HZ3' ' CD ' ' A' ' 11' ' ' GLU . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.45 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.45 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.547 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 51' ' ' MET . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.436 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.484 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.416 ' C ' ' HG1' ' A' ' 62' ' ' THR . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.436 ' HB ' HD22 ' A' ' 60' ' ' ASN . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.582 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.431 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.582 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.472 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.448 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.487 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.449 ' O ' HG22 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.669 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.669 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.442 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.442 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 125' ' ' ILE . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.481 ' HE3' ' CE1' ' B' ' 12' ' ' TYR . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.489 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.487 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.647 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 t0 . . . . . 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.433 ' H ' ' C ' ' A' ' 21' ' ' LYS . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.623 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.623 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.73 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.545 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.516 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.487 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.43 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.545 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE3' ' C ' ' B' ' 3' ' ' CYS . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.495 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 142' ' ' VAL . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.601 ' O ' HG22 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.535 ' HB1' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.512 HG13 ' HB ' ' A' ' 136' ' ' VAL . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.633 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.633 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.499 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.548 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.449 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.499 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.42 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.458 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.458 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' VAL . . . . . 0.512 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.701 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.417 ' HA ' HG21 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' MET . . . . . 0.562 ' SD ' HG22 ' B' ' 8' ' ' THR . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.53 ' N ' HD22 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ASP . . . . . 0.542 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' CYS . . . . . 0.482 ' C ' ' HE3' ' A' ' 71' ' ' MET . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' THR . . . . . 0.562 HG22 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.701 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . 0.414 ' HD2' ' OD1' ' B' ' 18' ' ' ASP . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ASP . . . . . 0.414 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.44 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.423 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.461 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.422 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.663 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.663 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HB2' ' CB ' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.653 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.653 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.485 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.528 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.528 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.494 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.402 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.517 ' O ' HG22 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.536 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.663 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.663 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.502 ' O ' HG21 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.502 HG21 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.755 ' HZ1' ' P ' ' B' ' 19' ' ' TPO . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' CD2' ' HB3' ' A' ' 120' ' ' GLU . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.452 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.557 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.628 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.555 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.557 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.531 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.434 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.586 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.717 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.617 ' HE3' ' CE2' ' B' ' 12' ' ' TYR . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.469 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . 0.576 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.485 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' CYS . . . . . 0.576 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.717 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.36 155.08 30.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TPO . . . . . 0.755 ' P ' ' HZ1' ' A' ' 115' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.488 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.448 ' CD ' ' HZ3' ' B' ' 10' ' ' LYS . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.614 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.438 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.528 HD13 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.631 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.483 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.631 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.484 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.483 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.48 HD13 ' SG ' ' B' ' 3' ' ' CYS . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.61 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.614 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.52 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HZ3' ' HB3' ' A' ' 84' ' ' GLU . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.412 HD12 HG22 ' A' ' 85' ' ' ILE . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.477 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.56 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.56 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.433 ' CD2' HD22 ' A' ' 111' ' ' ASN . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.433 HD22 ' CD2' ' A' ' 107' ' ' HIS . 89.5 m-20 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.737 ' HZ1' ' P ' ' B' ' 19' ' ' TPO . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 115' ' ' LYS . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.4 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.4 ' HB2' ' N ' ' A' ' 117' ' ' THR . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.542 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.519 ' SD ' ' CE1' ' B' ' 12' ' ' TYR . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.445 ' CG ' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 142' ' ' VAL . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.494 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 138' ' ' TYR . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . 0.528 ' CB ' HD13 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' CYS . . . . . 0.52 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . 0.448 ' HZ3' ' CD ' ' A' ' 11' ' ' GLU . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -71.44 156.31 39.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TPO . . . . . 0.737 ' P ' ' HZ1' ' A' ' 115' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.45 ' CG ' ' HG1' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.45 ' HG1' ' CG ' ' A' ' 24' ' ' ASP . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.547 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 51' ' ' MET . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.666 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.43 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.436 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.484 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.416 ' C ' ' HG1' ' A' ' 62' ' ' THR . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.436 ' HB ' HD22 ' A' ' 60' ' ' ASN . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.582 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.431 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.582 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.472 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.448 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.487 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.449 ' O ' HG22 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.669 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.669 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.707 ' HZ1' ' P ' ' B' ' 19' ' ' TPO . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.442 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.442 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.59 ' O ' HG12 ' A' ' 125' ' ' ILE . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.481 ' HE3' ' CE1' ' B' ' 12' ' ' TYR . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.59 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.489 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.487 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.647 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -77.14 158.76 30.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TPO . . . . . 0.707 ' P ' ' HZ1' ' A' ' 115' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.433 ' H ' ' C ' ' A' ' 21' ' ' LYS . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.427 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.623 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.623 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.73 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.73 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.545 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.516 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.487 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.43 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.545 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . 0.482 ' HE3' ' C ' ' B' ' 3' ' ' CYS . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.495 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.458 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 142' ' ' VAL . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.601 ' O ' HG22 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.535 ' HB1' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.601 HG22 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.512 HG13 ' HB ' ' A' ' 136' ' ' VAL . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.633 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.633 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.773 ' HZ2' ' P ' ' B' ' 19' ' ' TPO . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.499 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.548 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.449 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.499 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.42 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.458 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.458 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' VAL . . . . . 0.512 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.701 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.417 ' HA ' HG21 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' MET . . . . . 0.562 ' SD ' HG22 ' B' ' 8' ' ' THR . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.53 ' N ' HD22 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . 0.542 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' CYS . . . . . 0.482 ' C ' ' HE3' ' A' ' 71' ' ' MET . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.53 HD22 ' N ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' THR . . . . . 0.562 HG22 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.701 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . 0.414 ' HD2' ' OD1' ' B' ' 18' ' ' ASP . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ASP . . . . . 0.414 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 -79.99 162.59 24.81 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TPO . . . . . 0.773 ' P ' ' HZ2' ' A' ' 115' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.441 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.474 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.438 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.672 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.513 ' HB2' ' HB2' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.513 ' HB2' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.479 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.536 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.617 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.536 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.502 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.448 HG21 ' HD2' ' B' ' 11' ' ' LYS . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.406 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.564 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 105' ' ' LEU . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.671 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.867 HD11 ' HD3' ' B' ' 13' ' ' ARG . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.411 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.554 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.63 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.564 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.554 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.43 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.723 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.476 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ASP . . . . . 0.587 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 5' ' ' CYS . . . . . 0.587 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' B' ' 6' ' ' ILE . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.448 ' HD2' HG21 ' A' ' 79' ' ' THR . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.723 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.867 ' HD3' HD11 ' A' ' 116' ' ' LEU . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' H ' HG13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.485 HD11 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.41 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.553 ' HA ' HG21 ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.523 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.41 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.57 HG23 ' HG3' ' A' ' 145' ' ' MET . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB2' HG21 ' B' ' 8' ' ' THR . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 100' ' ' ILE . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 92' ' ' PHE . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CG1' ' A' ' 121' ' ' VAL . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.526 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.432 ' CG ' HD12 ' A' ' 116' ' ' LEU . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.912 HD23 ' HB3' ' A' ' 120' ' ' GLU . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.407 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.912 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.537 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.528 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.495 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.517 HG22 HG21 ' A' ' 85' ' ' ILE . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.57 ' HG3' HG23 ' A' ' 85' ' ' ILE . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ASP . . . . . 0.485 ' CB ' HD11 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 3' ' ' CYS . . . . . 0.532 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 71' ' ' MET . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' THR . . . . . 0.437 HG21 ' HB2' ' A' ' 88' ' ' ALA . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.497 ' HD3' HD11 ' A' ' 116' ' ' LEU . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.426 ' HA ' HD12 ' A' ' 39' ' ' LEU . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 36' ' ' MET . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.649 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.649 ' HB2' ' H ' ' A' ' 44' ' ' THR . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.682 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.682 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.447 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.58 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HB2' HD22 ' B' ' 4' ' ' LEU . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.462 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.4 ' HA ' HG21 ' A' ' 108' ' ' VAL . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.595 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.595 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.598 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.592 HD23 HG13 ' A' ' 121' ' ' VAL . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 106' ' ' ARG . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 104' ' ' GLU . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.418 ' HG ' HD21 ' A' ' 39' ' ' LEU . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.509 HD21 ' HD3' ' B' ' 13' ' ' ARG . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.451 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 105' ' ' LEU . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.495 ' SD ' HD21 ' A' ' 105' ' ' LEU . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 124' ' ' MET . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.585 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.462 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.663 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 75' ' ' LYS . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.509 ' HD3' HD21 ' A' ' 116' ' ' LEU . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 27.0 t0 . . . . . 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 19' ' ' PHE . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 18' ' ' LEU . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.458 ' HG2' ' HB2' ' A' ' 41' ' ' GLN . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.739 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.739 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.582 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.507 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.582 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . 0.471 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.77 ' HB3' HG11 ' B' ' 7' ' ' VAL . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.4 HG21 ' HD2' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.605 HG23 ' HG3' ' A' ' 145' ' ' MET . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.525 ' CB ' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.475 ' O ' HG21 ' A' ' 100' ' ' ILE . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.586 HG22 ' OE1' ' A' ' 104' ' ' GLU . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.605 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.586 ' OE1' HG22 ' A' ' 100' ' ' ILE . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 100' ' ' ILE . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.856 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.856 HD12 ' HG2' ' A' ' 109' ' ' MET . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.496 ' HB3' HD23 ' A' ' 116' ' ' LEU . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.494 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.552 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.494 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.463 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.463 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' VAL . . . . . 0.539 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.476 ' O ' HG23 ' A' ' 142' ' ' VAL . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.7 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.566 ' HA ' HD13 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' MET . . . . . 0.605 ' HG3' HG23 ' A' ' 85' ' ' ILE . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.54 ' N ' HD23 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ASP . . . . . 0.553 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' B' ' 5' ' ' CYS . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 5' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ILE . . . . . 0.468 HD13 ' HA ' ' B' ' 6' ' ' ILE . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.77 HG11 ' HB3' ' A' ' 75' ' ' LYS . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' THR . . . . . 0.582 HG23 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.518 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.7 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.756 ' HD3' HD11 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.441 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.474 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.438 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.672 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.513 ' HB2' ' HB2' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.513 ' HB2' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.479 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.536 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.617 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.536 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.502 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.448 HG21 ' HD2' ' B' ' 11' ' ' LYS . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.406 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.564 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 105' ' ' LEU . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.671 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.867 HD11 ' HD3' ' B' ' 13' ' ' ARG . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.411 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.554 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.63 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.564 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.554 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.43 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.723 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.476 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ASP . . . . . 0.587 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 5' ' ' CYS . . . . . 0.587 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' B' ' 6' ' ' ILE . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.448 ' HD2' HG21 ' A' ' 79' ' ' THR . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.723 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.867 ' HD3' HD11 ' A' ' 116' ' ' LEU . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.36 155.08 30.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' H ' HG13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.485 HD11 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.41 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.553 ' HA ' HG21 ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.523 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.41 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.57 HG23 ' HG3' ' A' ' 145' ' ' MET . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB2' HG21 ' B' ' 8' ' ' THR . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 100' ' ' ILE . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 92' ' ' PHE . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CG1' ' A' ' 121' ' ' VAL . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.526 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.432 ' CG ' HD12 ' A' ' 116' ' ' LEU . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.912 HD23 ' HB3' ' A' ' 120' ' ' GLU . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.407 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.912 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.537 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.528 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.495 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.517 HG22 HG21 ' A' ' 85' ' ' ILE . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.57 ' HG3' HG23 ' A' ' 85' ' ' ILE . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ASP . . . . . 0.485 ' CB ' HD11 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' CYS . . . . . 0.532 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 71' ' ' MET . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.437 HG21 ' HB2' ' A' ' 88' ' ' ALA . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.497 ' HD3' HD11 ' A' ' 116' ' ' LEU . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -71.44 156.31 39.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.426 ' HA ' HD12 ' A' ' 39' ' ' LEU . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 36' ' ' MET . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.649 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.649 ' HB2' ' H ' ' A' ' 44' ' ' THR . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.682 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.682 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.447 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.58 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HB2' HD22 ' B' ' 4' ' ' LEU . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.462 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.4 ' HA ' HG21 ' A' ' 108' ' ' VAL . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.595 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.595 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.598 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.592 HD23 HG13 ' A' ' 121' ' ' VAL . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 106' ' ' ARG . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 104' ' ' GLU . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.418 ' HG ' HD21 ' A' ' 39' ' ' LEU . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.509 HD21 ' HD3' ' B' ' 13' ' ' ARG . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.451 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 105' ' ' LEU . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.495 ' SD ' HD21 ' A' ' 105' ' ' LEU . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 124' ' ' MET . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.585 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.462 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.663 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 75' ' ' LYS . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.509 ' HD3' HD21 ' A' ' 116' ' ' LEU . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 27.0 t0 -77.14 158.76 30.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 19' ' ' PHE . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 18' ' ' LEU . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.458 ' HG2' ' HB2' ' A' ' 41' ' ' GLN . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.739 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.739 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.582 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.507 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.582 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . 0.471 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.77 ' HB3' HG11 ' B' ' 7' ' ' VAL . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.4 HG21 ' HD2' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.605 HG23 ' HG3' ' A' ' 145' ' ' MET . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.525 ' CB ' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.475 ' O ' HG21 ' A' ' 100' ' ' ILE . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.586 HG22 ' OE1' ' A' ' 104' ' ' GLU . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.605 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.586 ' OE1' HG22 ' A' ' 100' ' ' ILE . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 100' ' ' ILE . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.856 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.856 HD12 ' HG2' ' A' ' 109' ' ' MET . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.496 ' HB3' HD23 ' A' ' 116' ' ' LEU . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.494 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.552 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.494 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.463 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.463 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' VAL . . . . . 0.539 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.476 ' O ' HG23 ' A' ' 142' ' ' VAL . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.7 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.566 ' HA ' HD13 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' MET . . . . . 0.605 ' HG3' HG23 ' A' ' 85' ' ' ILE . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.54 ' N ' HD23 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ASP . . . . . 0.553 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' B' ' 5' ' ' CYS . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 5' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ILE . . . . . 0.468 HD13 ' HA ' ' B' ' 6' ' ' ILE . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.77 HG11 ' HB3' ' A' ' 75' ' ' LYS . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' THR . . . . . 0.582 HG23 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.518 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.7 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.756 ' HD3' HD11 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 -79.99 162.59 24.81 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.441 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.441 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.474 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.438 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.672 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.513 ' HB2' ' HB2' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.513 ' HB2' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.479 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.536 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.617 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.536 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.502 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.448 HG21 ' HD2' ' B' ' 11' ' ' LYS . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.406 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.564 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 105' ' ' LEU . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.671 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.867 HD11 ' HD3' ' B' ' 13' ' ' ARG . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.411 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.554 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.63 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.564 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.554 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.43 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.723 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.476 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . 0.587 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' CYS . . . . . 0.587 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' B' ' 6' ' ' ILE . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.448 ' HD2' HG21 ' A' ' 79' ' ' THR . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.723 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.867 ' HD3' HD11 ' A' ' 116' ' ' LEU . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 . . . . . 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' H ' HG13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.485 HD11 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.41 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.553 ' HA ' HG21 ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.523 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.41 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.57 HG23 ' HG3' ' A' ' 145' ' ' MET . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB2' HG21 ' B' ' 8' ' ' THR . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 100' ' ' ILE . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 92' ' ' PHE . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CG1' ' A' ' 121' ' ' VAL . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.486 ' CD2' HD21 ' A' ' 111' ' ' ASN . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.526 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.486 HD21 ' CD2' ' A' ' 107' ' ' HIS . 89.5 m-20 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.432 ' CG ' HD12 ' A' ' 116' ' ' LEU . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.912 HD23 ' HB3' ' A' ' 120' ' ' GLU . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.407 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.912 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.537 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.528 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.495 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.517 HG22 HG21 ' A' ' 85' ' ' ILE . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.57 ' HG3' HG23 ' A' ' 85' ' ' ILE . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . 0.485 ' CB ' HD11 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' CYS . . . . . 0.532 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 71' ' ' MET . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' THR . . . . . 0.437 HG21 ' HB2' ' A' ' 88' ' ' ALA . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.497 ' HD3' HD11 ' A' ' 116' ' ' LEU . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.426 ' HA ' HD12 ' A' ' 39' ' ' LEU . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 36' ' ' MET . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.649 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.649 ' HB2' ' H ' ' A' ' 44' ' ' THR . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.682 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.682 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.447 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.58 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HB2' HD22 ' B' ' 4' ' ' LEU . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.462 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.4 ' HA ' HG21 ' A' ' 108' ' ' VAL . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.595 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.595 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.598 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.592 HD23 HG13 ' A' ' 121' ' ' VAL . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 106' ' ' ARG . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 104' ' ' GLU . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.418 ' HG ' HD21 ' A' ' 39' ' ' LEU . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.509 HD21 ' HD3' ' B' ' 13' ' ' ARG . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.451 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 105' ' ' LEU . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.495 ' SD ' HD21 ' A' ' 105' ' ' LEU . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 124' ' ' MET . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.585 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.462 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.663 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 75' ' ' LYS . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.509 ' HD3' HD21 ' A' ' 116' ' ' LEU . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 27.0 t0 . . . . . 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 19' ' ' PHE . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 18' ' ' LEU . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.458 ' HG2' ' HB2' ' A' ' 41' ' ' GLN . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.739 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.739 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.582 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.507 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.582 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . 0.471 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.77 ' HB3' HG11 ' B' ' 7' ' ' VAL . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.4 HG21 ' HD2' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.605 HG23 ' HG3' ' A' ' 145' ' ' MET . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.525 ' CB ' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.475 ' O ' HG21 ' A' ' 100' ' ' ILE . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.586 HG22 ' OE1' ' A' ' 104' ' ' GLU . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.605 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.586 ' OE1' HG22 ' A' ' 100' ' ' ILE . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 100' ' ' ILE . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.856 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.856 HD12 ' HG2' ' A' ' 109' ' ' MET . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.496 ' HB3' HD23 ' A' ' 116' ' ' LEU . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.494 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.552 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.494 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.463 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.463 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' VAL . . . . . 0.539 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.476 ' O ' HG23 ' A' ' 142' ' ' VAL . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.7 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.566 ' HA ' HD13 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' MET . . . . . 0.605 ' HG3' HG23 ' A' ' 85' ' ' ILE . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.54 ' N ' HD23 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ASP . . . . . 0.553 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' B' ' 5' ' ' CYS . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ILE . . . . . 0.468 HD13 ' HA ' ' B' ' 6' ' ' ILE . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.77 HG11 ' HB3' ' A' ' 75' ' ' LYS . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' THR . . . . . 0.582 HG23 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.518 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.7 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.756 ' HD3' HD11 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.7 tp . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 121.037 0.446 . . . . 10.0 110.716 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -92.98 133.68 35.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.779 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.81 -40.7 66.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.532 0.682 . . . . 10.0 109.808 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -56.32 -28.62 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.046 -0.979 . . . . 10.0 111.129 178.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -122.3 36.75 4.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.0 tt -63.6 -30.61 50.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 114.089 1.144 . . . . 10.0 114.089 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -143.21 23.8 1.82 Allowed 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.78 -0.575 . . . . 10.0 111.569 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -57.72 -55.23 37.61 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.345 -0.388 . . . . 10.0 110.311 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -47.28 -40.14 16.14 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.998 177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mtpm? -66.74 -41.34 88.02 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.09 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -55.59 -51.04 68.46 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.608 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.14 -59.24 5.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.831 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.441 ' HE1' ' O ' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -47.51 -45.12 26.18 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.484 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.2 m -48.93 -26.84 2.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.545 -0.752 . . . . 10.0 112.686 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.53 -20.23 15.81 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.168 0.433 . . . . 10.0 112.168 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -83.77 -69.02 0.67 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 122.209 -0.307 . . . . 10.0 111.113 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -53.7 165.7 0.4 Allowed 'General case' 0 N--CA 1.469 0.489 0 O-C-N 123.202 0.314 . . . . 10.0 110.255 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -150.08 -43.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 108.722 -0.844 . . . . 10.0 108.722 -177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 30.2 p30 -66.71 10.42 0.13 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.378 1.251 . . . . 10.0 114.378 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.9 12.27 34.94 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 115.708 1.043 . . . . 10.0 115.708 178.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.42 -30.55 17.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.638 1.209 . . . . 10.0 107.846 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.441 ' O ' ' HE1' ' A' ' 16' ' ' PHE . . . 81.82 40.0 11.21 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 113.106 -1.861 . . . . 10.0 114.62 176.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 63.2 p -144.71 126.48 15.26 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 105.771 -1.937 . . . . 10.0 105.771 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.19 113.95 23.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 C-N-CA 119.869 -0.732 . . . . 10.0 110.319 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.0 p -90.86 -174.07 3.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.409 -0.359 . . . . 10.0 111.107 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -54.44 46.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.544 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 73.9 tttt -64.16 -32.96 74.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.283 -0.417 . . . . 10.0 112.104 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -72.47 -43.82 63.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.792 0.33 . . . . 10.0 110.26 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.474 ' HG ' ' OD1' ' B' ' 2' ' ' ASP . 1.1 tp -63.35 -40.71 98.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.138 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.57 -47.93 67.8 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.187 -0.915 . . . . 10.0 114.15 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -49.45 71.2 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.221 0.51 . . . . 10.0 112.224 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.7 t -55.31 -42.92 69.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.621 -0.718 . . . . 10.0 110.681 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.438 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 2.1 ttt -70.93 -40.39 72.11 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.676 179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.672 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 52.8 ttp180 -63.07 -36.38 83.4 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.267 -0.879 . . . . 10.0 111.56 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 55.9 m -64.86 -13.19 55.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.921 0.391 . . . . 10.0 111.628 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.5 mt -97.57 -0.26 46.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 10.0 111.188 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.15 -14.4 40.2 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.585 -0.817 . . . . 10.0 113.451 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 83.2 mm-40 -82.67 130.5 35.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.82 0.31 . . . . 10.0 110.804 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -134.41 87.67 31.96 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.962 0.411 . . . . 10.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.513 ' HB2' ' HB2' ' A' ' 47' ' ' GLU . 58.0 Cg_endo -99.26 -172.93 0.13 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.643 2.896 . . . . 10.0 112.484 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.1 p -107.44 -176.93 3.2 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.893 0.378 . . . . 10.0 111.505 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.61 -42.62 79.07 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.939 -0.573 . . . . 10.0 111.702 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -60.52 -34.62 74.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.158 0.504 . . . . 10.0 111.606 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.513 ' HB2' ' HB2' ' A' ' 43' ' ' PRO . 2.7 mp0 -74.31 -36.19 63.7 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.71 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.8 mt -77.58 -45.75 24.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.915 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -65.67 -31.37 72.35 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.087 0.47 . . . . 10.0 110.623 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 18.8 t70 -63.83 -36.75 84.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.648 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.664 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 13.6 mmt -63.13 -48.81 76.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.415 -0.812 . . . . 10.0 110.093 179.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 7.9 mm -51.09 -52.9 16.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.72 0 C-N-CA 120.723 -0.391 . . . . 10.0 110.956 177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -50.9 -28.14 9.0 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 123.775 0.672 . . . . 10.0 110.954 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB3' ' O ' ' A' ' 51' ' ' MET . 1.3 tt0 -65.86 -30.59 71.22 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.568 -1.196 . . . . 10.0 110.38 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.479 HG22 ' SD ' ' A' ' 71' ' ' MET . 46.2 t -105.81 -52.58 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 121.041 0.448 . . . . 10.0 111.172 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.536 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.5 t70 -56.24 131.45 47.98 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.33 -0.85 . . . . 10.0 111.484 -178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -135.9 6.32 3.14 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.624 -0.716 . . . . 10.0 111.44 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -100.32 -5.47 27.34 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.775 -0.37 . . . . 10.0 111.243 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.54 6.04 86.19 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.652 -0.785 . . . . 10.0 113.435 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -25.62 27.32 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.068 -0.666 . . . . 10.0 109.669 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 80.2 32.76 34.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.898 -0.668 . . . . 10.0 113.512 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.0 m -157.02 131.12 8.38 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.3 mt -68.34 123.71 22.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.279 -1.008 . . . . 10.0 108.279 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -119.39 -137.14 0.34 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 119.264 -0.398 . . . . 10.0 110.036 -178.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' HB3' ' HD3' ' A' ' 66' ' ' PRO . 18.5 t80 -89.15 -50.7 0.38 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 119.33 0.968 . . . . 10.0 112.909 -178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.617 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 75.1 Cg_exo -52.06 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.357 0.986 0 C-N-CA 121.633 1.555 . . . . 10.0 111.73 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.536 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 10.1 mt-10 -59.0 -23.16 61.65 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.206 178.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 1.1 t80 -82.38 -5.59 58.73 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.773 -1.103 . . . . 10.0 110.436 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.7 mt -114.06 -37.86 4.33 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.451 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 90.7 m -70.68 -54.3 12.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.158 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.502 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 10.2 ttp -68.09 -19.0 64.82 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-O 121.731 0.777 . . . . 10.0 109.413 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -62.83 -32.63 73.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.272 -1.331 . . . . 10.0 108.656 178.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -92.43 -49.99 5.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.591 -0.731 . . . . 10.0 109.903 178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 96.3 mtt180 -37.51 -59.97 0.73 Allowed 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.672 0.607 . . . . 10.0 112.44 178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 30.1 tptt -59.69 -33.92 72.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.111 -0.495 . . . . 10.0 112.213 -178.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.8 ttt -74.12 -11.87 60.43 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.38 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -111.87 -33.57 6.26 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.16 0.505 . . . . 10.0 110.466 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -93.62 23.8 4.45 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.765 -0.652 . . . . 10.0 111.624 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.448 HG21 ' HD2' ' B' ' 11' ' ' LYS . 1.4 m -60.23 -56.03 26.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.705 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -83.6 87.36 7.03 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.472 -0.566 . . . . 10.0 109.472 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.17 -76.35 0.58 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.74 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HB3' ' H ' ' A' ' 83' ' ' GLU . 6.8 tp10 -174.8 -90.13 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.406 ' H ' ' HB3' ' A' ' 82' ' ' GLU . 12.5 pt-20 -70.36 -21.43 62.88 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.429 -0.35 . . . . 10.0 111.6 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -60.88 -28.61 69.0 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.013 0.435 . . . . 10.0 110.775 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 72.8 mt -74.5 -25.5 19.37 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.996 0.903 . . . . 10.0 109.327 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -86.78 -27.96 23.26 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.852 -1.166 . . . . 10.0 107.852 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.564 ' O ' HG23 ' A' ' 91' ' ' VAL . 10.9 tt0 -59.81 -57.42 12.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.559 -1.201 . . . . 10.0 110.26 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.02 -42.79 99.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.445 -0.576 . . . . 10.0 109.445 179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.418 ' HZ ' ' O ' ' A' ' 98' ' ' GLY . 34.9 t80 -57.27 -32.72 66.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.124 178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 43.6 ttp180 -72.45 -27.59 62.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.651 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -96.73 2.14 10.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 121.117 0.484 . . . . 10.0 109.987 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 5.7 m-85 -115.07 8.83 15.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.326 0.584 . . . . 10.0 109.76 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -136.09 154.75 50.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.886 -1.052 . . . . 10.0 108.389 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -137.03 -38.49 0.63 Allowed 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.793 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -72.52 -24.47 61.15 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.137 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.04 64.2 3.26 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 110.459 -1.056 . . . . 10.0 110.459 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 p-10 -125.67 -23.08 4.1 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 122.879 -0.189 . . . . 10.0 111.339 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.418 ' O ' ' HZ ' ' A' ' 89' ' ' PHE . . . 119.99 -10.74 10.99 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.036 -1.078 . . . . 10.0 114.704 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -150.93 153.88 36.09 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 118.396 1.098 . . . . 10.0 111.771 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.535 HG12 ' O ' ' A' ' 92' ' ' PHE . 0.2 OUTLIER -129.84 146.58 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.697 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.593 ' C ' ' H ' ' A' ' 103' ' ' ALA . 3.0 p -143.04 -134.1 0.09 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.542 -0.91 . . . . 10.0 108.542 178.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.76 35.6 0.37 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-O 123.376 1.56 . . . . 10.0 108.496 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.83 -117.57 0.16 Allowed 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 111.29 -2.686 . . . . 10.0 111.371 -178.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.5 ' O ' HG23 ' A' ' 108' ' ' VAL . 0.1 OUTLIER -66.88 -6.75 17.68 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.352 -0.84 . . . . 10.0 113.04 -178.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 105' ' ' LEU . 2.8 tp -63.24 -56.48 16.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.634 0.254 . . . . 10.0 110.411 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.5 ttm105 -51.49 -43.26 62.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.181 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -62.03 -39.73 93.3 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.801 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 104' ' ' GLU . 41.6 t -61.16 -51.3 74.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.644 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.671 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.2 mpt? -60.4 -51.02 71.25 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 8.6 m -57.41 -23.44 49.43 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.899 0.703 . . . . 10.0 112.899 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -107.74 3.27 24.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 3.7 mt -114.27 -53.35 2.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.562 0.22 . . . . 10.0 111.492 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 135.67 60.63 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.079 -1.058 . . . . 10.0 113.231 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -151.9 129.32 11.35 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 110.205 -0.295 . . . . 10.0 110.205 179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.462 ' O ' ' HG2' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -85.38 121.95 28.84 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.867 HD11 ' HD3' ' B' ' 13' ' ' ARG . 35.6 mt -157.61 103.48 1.93 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.174 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.411 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 34.1 p -82.44 170.55 15.15 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.755 -0.831 . . . . 10.0 108.755 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -42.69 -55.82 3.42 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.805 1.039 . . . . 10.0 113.805 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.39 -17.31 64.43 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 121.48 0.657 . . . . 10.0 111.652 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.46 ' HB3' ' CD2' ' A' ' 116' ' ' LEU . 4.5 mt-10 -79.94 -48.4 13.47 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.687 -1.142 . . . . 10.0 108.589 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 125' ' ' ILE . 22.3 t -70.28 -28.85 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 109.564 -0.532 . . . . 10.0 109.564 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -55.93 -43.85 77.77 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.554 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 3.5 tp10 -57.25 -50.38 73.08 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.266 -1.013 . . . . 10.0 108.266 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.63 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 28.2 ttm -60.31 -19.16 54.05 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 114.453 -1.249 . . . . 10.0 112.03 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.564 HG12 ' O ' ' A' ' 121' ' ' VAL . 33.4 mm -77.18 -50.74 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 N-CA-C 108.079 -1.082 . . . . 10.0 108.079 -178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.554 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 30.6 mtm105 -74.45 -3.17 29.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.118 0.961 . . . . 10.0 109.531 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.74 -37.67 22.36 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.979 -1.464 . . . . 10.0 109.386 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.3 29.72 6.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.373 -0.376 . . . . 10.0 111.838 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.9 t0 -107.33 49.28 0.81 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.743 0.306 . . . . 10.0 111.385 -179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 11.1 mm -42.79 -51.8 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.523 0.564 . . . . 10.0 112.523 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -28.4 69.95 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.255 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.43 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.19 59.0 3.23 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 114.493 0.557 . . . . 10.0 114.493 177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -128.52 7.56 5.81 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.675 -0.861 . . . . 10.0 108.675 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.2 56.63 11.41 Favored Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.836 -1.074 . . . . 10.0 110.596 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.422 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 6.7 tt0 -171.87 169.37 5.8 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.876 0.369 . . . . 10.0 110.679 -178.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.89 134.14 67.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 114.943 -1.026 . . . . 10.0 108.702 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -143.3 176.44 9.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.584 -0.524 . . . . 10.0 109.584 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 142' ' ' VAL . 66.7 t80 -50.79 -56.14 13.49 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.352 0.408 . . . . 10.0 111.675 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -51.66 -33.95 35.95 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.252 0.834 . . . . 10.0 113.252 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -87.08 -48.54 7.99 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.902 -0.319 . . . . 10.0 111.673 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.723 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 3.8 t80 -52.52 -40.37 62.37 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 138' ' ' TYR . 63.9 t -55.45 -44.78 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.835 0.35 . . . . 10.0 111.334 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -69.86 -45.14 68.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.802 0.334 . . . . 10.0 110.712 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -35.51 80.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.129 -0.487 . . . . 10.0 111.215 -178.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.5 mmm -62.08 -4.75 1.81 Allowed 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.437 0.902 . . . . 10.0 113.437 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 1.2 m -137.97 -35.11 0.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 O-C-N 121.618 -0.676 . . . . 10.0 110.457 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.263 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.476 ' SD ' ' HG3' ' A' ' 51' ' ' MET . 7.4 ptt? . . . . . 0 N--CA 1.456 -0.164 0 CA-C-O 121.224 0.535 . . . . 10.0 110.505 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . 0.587 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 22.9 m-20 -79.0 -28.75 43.44 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.715 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.41 -43.92 76.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.856 0.36 . . . . 10.0 111.303 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.444 ' H ' ' HG ' ' B' ' 4' ' ' LEU . 0.4 OUTLIER -77.11 -36.11 55.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.862 0.319 . . . . 10.0 111.862 -179.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' CYS . . . . . 0.587 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 15.0 p -67.86 -30.57 69.97 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.35 -0.611 . . . . 10.0 109.35 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.456 HD13 ' HA ' ' B' ' 6' ' ' ILE . 0.8 OUTLIER -63.81 -46.52 94.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.1 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.61 -43.16 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.518 -0.765 . . . . 10.0 110.284 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 43.2 m -63.66 -38.95 93.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 52.8 m -60.42 -38.59 84.53 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -68.84 -39.73 79.81 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.515 -0.766 . . . . 10.0 110.309 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.448 ' HD2' HG21 ' A' ' 79' ' ' THR . 4.4 tmtm? -70.18 -29.23 66.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.723 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 61.4 t80 -79.96 -28.03 39.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.289 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.867 ' HD3' HD11 ' A' ' 116' ' ' LEU . 3.2 mtm180 -83.37 -54.29 5.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.114 179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -72.81 90.39 1.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.559 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -120.49 -65.86 1.11 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.077 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -162.06 -53.54 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.932 0.396 . . . . 10.0 110.108 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -68.39 -80.34 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.545 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.36 155.08 30.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.616 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 26.2 tp . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.99 0.424 . . . . 10.0 110.63 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 m -100.79 143.26 31.16 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.713 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 10.6 tt0 -52.63 -41.21 63.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.397 -0.82 . . . . 10.0 110.197 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -55.19 -21.86 15.34 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 114.936 -1.029 . . . . 10.0 112.12 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -129.42 29.52 5.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.495 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.3 OUTLIER -51.96 -31.39 13.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 115.124 -0.944 . . . . 10.0 113.25 -177.355 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 14' ' ' GLU . . . -135.01 23.61 3.56 Favored 'General case' 0 N--CA 1.452 -0.33 0 O-C-N 121.796 -0.565 . . . . 10.0 111.173 -179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.11 -59.25 5.37 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 19.8 m-85 -42.53 -43.26 3.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.821 -0.627 . . . . 10.0 111.9 176.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -64.82 -35.77 82.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.527 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 10' ' ' ALA . 12.9 mm-40 -58.65 -53.01 63.19 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.379 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 18' ' ' LEU . . . -61.2 -57.73 11.25 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.766 0.317 . . . . 10.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -46.98 -54.28 10.49 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.288 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.8 m -58.85 -17.93 28.18 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.487 -0.779 . . . . 10.0 111.736 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -87.63 -37.97 16.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.154 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -87.33 -59.04 2.36 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.347 -0.221 . . . . 10.0 111.585 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -56.17 160.57 2.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 120.675 0.274 . . . . 10.0 111.089 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -155.61 -37.73 0.09 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -70.13 8.09 0.83 Allowed 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.67 -1.15 . . . . 10.0 113.186 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 60.79 14.34 36.66 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 115.829 1.091 . . . . 10.0 115.829 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -31.55 17.72 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.582 1.182 . . . . 10.0 107.874 178.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.33 39.27 19.36 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 112.92 -1.946 . . . . 10.0 114.938 176.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.6 p -140.85 146.23 37.26 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 106.754 -1.573 . . . . 10.0 106.754 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' H ' HG13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -94.07 114.18 30.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 120.489 0.185 . . . . 10.0 111.263 -178.304 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -107.26 -170.48 1.71 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.092 0.472 . . . . 10.0 111.808 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.93 -61.66 2.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.141 -0.936 . . . . 10.0 112.521 -178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 72.5 tttt -58.72 -32.04 68.84 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.861 0.362 . . . . 10.0 111.813 -178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -70.59 -34.9 72.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.96 0.41 . . . . 10.0 111.945 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.485 HD11 ' CB ' ' B' ' 2' ' ' ASP . 13.1 tp -77.09 -25.51 52.33 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.239 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.54 -50.42 60.39 Favored Glycine 0 CA--C 1.518 0.263 0 CA-C-N 115.916 -0.584 . . . . 10.0 113.119 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -48.64 80.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.963 0.411 . . . . 10.0 111.395 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.4 t -55.73 -52.62 46.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.312 -0.858 . . . . 10.0 110.606 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 tpt -59.29 -41.69 89.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.093 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -61.43 -41.48 97.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.766 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 49.8 m -63.94 -35.83 81.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.969 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 63.0 mt -65.64 -16.63 63.92 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.187 -0.461 . . . . 10.0 111.24 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 102.03 17.45 20.56 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.63 -0.795 . . . . 10.0 112.416 179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -120.91 142.71 49.46 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.631 -0.507 . . . . 10.0 109.631 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -128.66 84.84 61.92 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.995 0.426 . . . . 10.0 111.575 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -85.31 160.02 11.22 Favored 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 122.993 2.462 . . . . 10.0 112.119 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 42.7 p -83.17 -179.14 7.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.812 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.24 -50.99 71.15 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.679 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.62 -24.37 66.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.153 0.501 . . . . 10.0 110.651 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -83.62 7.4 17.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.548 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 44.5 mt -129.73 -43.89 1.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.623 -0.717 . . . . 10.0 110.464 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -63.28 -45.37 91.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.726 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -65.65 -22.95 66.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.819 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.646 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 20.8 mmt -67.37 -47.14 71.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' ' 62' ' ' THR . 19.9 mm -56.13 -54.15 30.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 176.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -53.21 -34.53 57.42 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.259 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.646 ' HB3' ' O ' ' A' ' 51' ' ' MET . 42.7 tt0 -52.35 -36.13 52.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.219 -1.355 . . . . 10.0 109.58 177.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.19 -37.25 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.545 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.41 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 2.6 t70 -51.95 133.08 32.75 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.538 -0.755 . . . . 10.0 112.232 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -133.9 -4.95 2.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.492 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 5.7 p-10 -100.64 -10.14 21.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.801 -0.181 . . . . 10.0 111.467 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.2 38.49 12.92 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.11 -1.043 . . . . 10.0 112.824 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -117.78 -15.91 10.04 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.462 -0.434 . . . . 10.0 110.28 179.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.7 35.82 54.44 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.898 -0.592 . . . . 10.0 113.723 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.553 ' HA ' HG21 ' A' ' 52' ' ' ILE . 23.5 m -160.99 129.82 4.62 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.141 0.47 . . . . 10.0 111.273 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 4.1 mt -63.81 121.05 12.05 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 178.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' A' ' 68' ' ' PHE . 0.6 OUTLIER -115.84 -141.42 0.37 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 -177.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 1.5 t80 -88.08 -49.54 0.43 Allowed Pre-proline 0 CA--C 1.533 0.308 0 CA-C-N 118.629 0.65 . . . . 10.0 112.243 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.523 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 56.9 Cg_exo -54.14 -51.31 10.93 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 121.468 1.445 . . . . 10.0 111.368 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.41 ' CD ' ' HA ' ' A' ' 56' ' ' ASP . 17.3 mt-10 -61.9 -23.54 66.39 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.516 0.674 . . . . 10.0 110.528 178.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 12' ' ' PHE . 2.4 t80 -73.05 -40.82 64.78 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.085 -1.416 . . . . 10.0 109.164 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 mt -78.39 -35.26 47.48 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.485 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.4 m -61.58 -40.38 94.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.228 0.537 . . . . 10.0 110.729 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 3' ' ' CYS . 3.7 ttp -65.47 -21.09 66.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.637 -0.71 . . . . 10.0 111.161 179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -71.14 -30.34 66.36 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.659 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.13 -63.99 1.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.106 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -37.33 -68.6 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 113.942 1.09 . . . . 10.0 113.942 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 44.3 tptt -61.67 -24.34 66.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.44 0.533 . . . . 10.0 112.44 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -76.16 -25.62 55.44 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 122.254 -0.279 . . . . 10.0 111.037 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -106.15 -13.94 15.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.805 0.335 . . . . 10.0 111.283 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -115.47 28.19 8.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.114 0.483 . . . . 10.0 110.297 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.73 -49.76 64.97 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.832 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.82 94.02 7.41 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.6 m -129.26 -59.52 1.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.248 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -168.49 -85.23 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 122.238 -0.288 . . . . 10.0 110.403 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -78.4 -14.29 59.45 Favored 'General case' 0 N--CA 1.463 0.225 0 O-C-N 122.34 -0.225 . . . . 10.0 111.406 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 7.0 mm-40 -55.87 -39.89 72.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.474 0.654 . . . . 10.0 110.751 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.57 HG23 ' HG3' ' A' ' 145' ' ' MET . 2.6 mt -64.96 -26.51 40.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 115.417 -0.81 . . . . 10.0 111.114 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -88.74 -24.08 22.76 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' GLU . 3.0 tt0 -59.24 -57.29 13.68 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.366 -0.834 . . . . 10.0 109.358 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.437 ' HB2' HG21 ' B' ' 8' ' ' THR . . . -62.88 -42.48 99.78 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.891 -0.324 . . . . 10.0 110.361 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -56.57 -36.92 69.88 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.981 0.419 . . . . 10.0 110.16 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -68.2 -27.68 66.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.837 -0.62 . . . . 10.0 111.708 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -107.47 9.63 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 C-N-CA 120.516 -0.474 . . . . 10.0 111.074 178.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.402 ' O ' HG12 ' A' ' 100' ' ' ILE . 2.4 m-85 -112.47 10.69 19.74 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -146.03 155.06 42.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.531 -1.213 . . . . 10.0 108.491 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -132.65 -34.21 1.18 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.686 0.279 . . . . 10.0 110.496 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -80.04 -33.02 39.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 10.0 111.045 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.44 72.3 1.2 Allowed Glycine 0 N--CA 1.448 -0.551 0 N-CA-C 110.961 -0.856 . . . . 10.0 110.961 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -128.88 -41.73 1.45 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.724 0.297 . . . . 10.0 110.808 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.21 -12.51 6.74 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.41 -0.9 . . . . 10.0 114.088 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -134.59 139.03 45.05 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 118.345 1.072 . . . . 10.0 109.739 -178.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 92' ' ' PHE . 2.5 mp -122.25 138.56 52.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.615 0.245 . . . . 10.0 111.348 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.497 ' C ' ' H ' ' A' ' 103' ' ' ALA . 14.7 p -132.17 -140.67 0.2 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -77.51 48.69 0.67 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 123.252 1.501 . . . . 10.0 108.232 176.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -116.47 -107.92 0.37 Allowed 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 111.794 -2.457 . . . . 10.0 112.532 -177.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -66.91 -15.44 63.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.116 -0.947 . . . . 10.0 113.071 -177.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.407 HD23 ' CG1' ' A' ' 121' ' ' VAL . 13.8 tp -69.51 -57.59 5.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.44 0.564 . . . . 10.0 110.682 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -48.7 -49.76 36.42 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.053 0.454 . . . . 10.0 111.345 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.486 ' CD2' HD21 ' A' ' 111' ' ' ASN . 85.1 t60 -62.35 -46.27 89.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.887 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.7 t -56.71 -48.03 81.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 O-C-N 123.211 0.319 . . . . 10.0 111.464 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.526 ' HG2' HD13 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -64.29 -44.81 90.5 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.084 -0.385 . . . . 10.0 110.776 -179.383 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 42.8 m -52.7 -35.69 56.01 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.538 177.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.486 HD21 ' CD2' ' A' ' 107' ' ' HIS . 89.5 m-20 -70.77 -24.65 62.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.099 0.476 . . . . 10.0 110.788 179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 76.9 mt -95.49 3.88 53.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.878 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 65.04 23.69 69.74 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.319 -0.467 . . . . 10.0 112.38 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.432 ' CG ' HD12 ' A' ' 116' ' ' LEU . 11.3 tp10 -82.65 138.01 34.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.606 0.241 . . . . 10.0 110.635 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.1 ttpt -81.47 104.54 11.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.282 -0.417 . . . . 10.0 110.315 179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.912 HD23 ' HB3' ' A' ' 120' ' ' GLU . 2.4 mt -156.83 108.11 2.39 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.976 0.417 . . . . 10.0 111.717 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.407 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 0.2 OUTLIER -101.76 175.91 5.4 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 176.946 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.87 -57.8 1.51 Allowed 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.16 1.17 . . . . 10.0 114.16 179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.32 -23.3 66.68 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.915 0.864 . . . . 10.0 111.756 -179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.912 ' HB3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -76.72 -52.68 9.15 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.632 -1.167 . . . . 10.0 108.928 -178.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.551 ' O ' HG12 ' A' ' 125' ' ' ILE . 5.7 t -72.85 -22.82 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 O-C-N 121.965 -0.459 . . . . 10.0 110.479 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.34 -50.7 70.75 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.01 -43.36 95.28 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.466 -0.938 . . . . 10.0 108.466 177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.537 ' HB3' ' HA ' ' A' ' 121' ' ' VAL . 20.0 ttm -61.52 -17.44 54.74 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 114.855 -1.066 . . . . 10.0 111.411 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 121' ' ' VAL . 26.7 mm -79.22 -47.35 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 N-CA-C 107.089 -1.449 . . . . 10.0 107.089 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 24.4 mtm105 -75.59 -0.5 20.7 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.405 0.622 . . . . 10.0 110.013 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -87.58 -43.1 12.24 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.59 -1.187 . . . . 10.0 109.541 178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.0 28.45 8.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 10.0 112.354 -179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.528 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -110.74 51.52 0.77 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.892 0.377 . . . . 10.0 111.461 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 22.5 mm -48.04 -44.9 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 178.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.9 -32.08 73.48 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.848 0.356 . . . . 10.0 110.301 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 80.76 59.22 2.52 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.822 -0.704 . . . . 10.0 114.386 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -129.6 7.72 5.31 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.004 -0.739 . . . . 10.0 109.004 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.01 56.57 11.97 Favored Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 114.802 -1.09 . . . . 10.0 110.891 -177.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.478 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.1 tt0 -172.15 174.21 4.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 120.865 0.364 . . . . 10.0 111.406 -178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 33.7 t -131.52 141.92 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.073 -0.967 . . . . 10.0 109.753 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -142.94 -173.92 4.03 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -63.68 -48.02 78.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.934 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -60.78 -33.65 73.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -79.84 -51.91 8.55 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 121.023 -0.271 . . . . 10.0 111.263 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.495 ' CE2' ' HD2' ' B' ' 12' ' ' TYR . 3.7 t80 -60.47 -28.75 68.58 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.533 0.206 . . . . 10.0 110.685 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.517 HG22 HG21 ' A' ' 85' ' ' ILE . 2.0 t -54.86 -41.91 60.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-O 120.737 0.303 . . . . 10.0 110.872 178.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.89 -44.43 80.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.899 0.381 . . . . 10.0 110.545 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 6.8 mtm -67.65 -33.16 74.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.646 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.57 ' HG3' HG23 ' A' ' 85' ' ' ILE . 65.6 mmm -54.17 -23.72 15.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 113.067 0.766 . . . . 10.0 113.067 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 2.4 m -104.52 -32.33 9.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.129 0.49 . . . . 10.0 110.483 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 CA-C-O 121.278 0.561 . . . . 10.0 111.489 -179.421 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . 0.485 ' CB ' HD11 ' A' ' 32' ' ' LEU . 9.6 t70 -84.58 -55.28 4.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.934 -179.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' CYS . . . . . 0.532 ' HB3' ' SD ' ' A' ' 71' ' ' MET . 33.9 m -53.85 -37.42 63.63 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.313 0.578 . . . . 10.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 14.2 mt -78.27 -35.28 48.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.701 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 7.4 t -65.91 -39.77 90.86 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 5.2 mm -58.58 -46.5 90.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.984 178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 71' ' ' MET . 37.5 t -65.58 -43.16 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.747 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.437 HG21 ' HB2' ' A' ' 88' ' ' ALA . 25.5 m -64.81 -36.08 83.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.093 0.473 . . . . 10.0 110.432 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 22.0 m -61.36 -41.81 97.67 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.046 -0.724 . . . . 10.0 109.046 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -62.73 -37.74 87.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.138 -0.937 . . . . 10.0 110.096 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -68.57 -39.48 80.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.281 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.519 ' CE1' ' SD ' ' A' ' 124' ' ' MET . 63.2 t80 -71.13 -23.56 62.11 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.955 -0.566 . . . . 10.0 110.911 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.497 ' HD3' HD11 ' A' ' 116' ' ' LEU . 9.5 mmm180 -86.14 -55.49 3.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.595 -179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -82.89 62.95 6.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.277 0.561 . . . . 10.0 110.56 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 9.2 mm100 -88.83 -76.82 0.39 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.718 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.75 -57.13 0.31 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -88.67 -48.5 7.5 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.227 0.455 . . . . 10.0 112.227 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -71.44 156.31 39.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.078 0.466 . . . . 10.0 111.175 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.2 tp . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.9 0.381 . . . . 10.0 110.342 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -62.32 126.32 26.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.592 -0.731 . . . . 10.0 112.658 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -51.7 -42.09 61.96 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 114.902 -1.044 . . . . 10.0 109.242 178.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -46.08 -32.47 2.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.819 -1.537 . . . . 10.0 112.507 178.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -134.05 37.98 3.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.577 0.703 . . . . 10.0 109.622 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.23 -19.0 24.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.223 -0.899 . . . . 10.0 112.509 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.23 14.19 6.69 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.796 -0.565 . . . . 10.0 111.451 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -57.96 -54.66 44.47 Favored 'General case' 0 N--CA 1.462 0.135 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -43.92 -44.07 6.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.128 -0.487 . . . . 10.0 111.958 177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -65.12 -35.38 80.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.555 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -60.58 -52.08 66.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.504 -0.771 . . . . 10.0 110.934 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.42 -54.89 41.65 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.305 -0.628 . . . . 10.0 109.305 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -44.57 -52.33 8.16 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.656 177.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.5 m -58.3 -11.15 2.47 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.3 -1.318 . . . . 10.0 113.713 179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.63 -41.83 3.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 118.515 0.598 . . . . 10.0 112.49 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -70.68 -67.79 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.468 -0.093 . . . . 10.0 111.114 -179.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -54.14 162.58 0.98 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 123.134 0.271 . . . . 10.0 110.457 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -149.48 -40.63 0.14 Allowed 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.688 -0.856 . . . . 10.0 108.688 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -70.91 13.02 0.22 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.531 -1.213 . . . . 10.0 114.042 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 61.43 13.82 38.88 Favored Glycine 0 N--CA 1.463 0.462 0 N-CA-C 115.991 1.156 . . . . 10.0 115.991 178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.57 -32.69 14.72 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.061 -1.089 . . . . 10.0 108.061 179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 82.33 39.68 10.88 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 113.318 -1.764 . . . . 10.0 114.662 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.3 p -139.83 138.4 35.75 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 106.222 -1.77 . . . . 10.0 106.222 177.005 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.14 108.55 19.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 120.817 -0.353 . . . . 10.0 111.478 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 17.1 p -97.41 -170.29 1.99 Allowed 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.054 0.454 . . . . 10.0 110.882 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.68 -57.43 12.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.469 -0.787 . . . . 10.0 112.402 -178.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -57.18 -36.06 70.34 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.59 0.959 . . . . 10.0 113.59 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -74.04 -41.52 61.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.028 0.442 . . . . 10.0 111.076 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.6 tp -65.31 -44.05 89.1 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.42 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.75 -36.87 60.27 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 116.107 -0.497 . . . . 10.0 113.156 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.1 m -65.43 -52.22 54.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.944 0.402 . . . . 10.0 110.775 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.4 -49.88 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.71 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.426 ' HA ' HD12 ' A' ' 39' ' ' LEU . 26.5 ttt -59.86 -44.58 94.06 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.511 -0.768 . . . . 10.0 111.81 -179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 38.4 ttp180 -65.0 -37.67 88.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.583 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.0 m -63.51 -30.45 71.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.287 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 36' ' ' MET . 34.6 mt -67.41 -28.96 68.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.939 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.15 11.74 4.15 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.054 -1.07 . . . . 10.0 114.166 178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 88.5 mm-40 -114.37 148.19 38.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 117.454 0.627 . . . . 10.0 110.729 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -116.28 102.49 53.59 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.182 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -95.97 -175.33 0.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.08 2.52 . . . . 10.0 113.395 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.649 ' H ' ' HB2' ' A' ' 47' ' ' GLU . 65.9 p -115.78 -172.46 2.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.382 -0.827 . . . . 10.0 109.003 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -71.85 -47.62 51.79 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.052 0.453 . . . . 10.0 110.058 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.59 63.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.144 0.497 . . . . 10.0 110.428 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.649 ' HB2' ' H ' ' A' ' 44' ' ' THR . 0.9 OUTLIER -75.45 -23.78 56.94 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.36 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' A' ' 51' ' ' MET . 20.2 mt -106.48 -35.75 6.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.409 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -66.03 -31.43 72.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.339 . . . . 10.0 110.781 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -80.47 -16.2 54.92 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.437 . . . . 10.0 110.211 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.682 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 22.8 mmt -67.19 -53.2 32.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.022 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.436 ' CG2' ' HA ' ' A' ' 62' ' ' THR . 0.1 OUTLIER -53.53 -53.67 23.54 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 109.767 -0.456 . . . . 10.0 109.767 176.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -47.81 -41.55 23.98 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.874 0.845 . . . . 10.0 110.344 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.682 ' HB3' ' O ' ' A' ' 51' ' ' MET . 2.1 tt0 -50.45 -47.12 56.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 113.648 -1.615 . . . . 10.0 110.931 179.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.476 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 2.0 t -91.54 -32.41 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.711 0.291 . . . . 10.0 111.5 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.447 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 10.0 t70 -56.85 134.42 55.27 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.814 -0.63 . . . . 10.0 112.201 -178.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -138.24 -0.01 2.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.157 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.496 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.7 OUTLIER -100.45 -12.09 19.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.921 0.391 . . . . 10.0 110.843 -179.408 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 89.18 13.01 62.58 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.739 -0.743 . . . . 10.0 113.701 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.496 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.1 OUTLIER -91.09 -19.04 23.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 117.641 0.721 . . . . 10.0 109.965 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 75.92 35.67 44.09 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.182 -0.533 . . . . 10.0 113.35 178.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 52' ' ' ILE . 14.1 m -160.8 136.02 7.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.867 0.333 . . . . 10.0 110.593 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 2.9 mt -68.16 118.66 12.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 106.947 -1.501 . . . . 10.0 106.947 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.58 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -118.83 -134.88 0.33 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -177.389 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.436 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 2.8 t80 -85.09 -49.98 0.57 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 118.581 0.628 . . . . 10.0 112.077 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 53.5 Cg_exo -54.65 -55.13 3.55 Favored 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 122.051 1.834 . . . . 10.0 112.519 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 3.9 mt-10 -59.78 -19.33 49.83 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.084 0.468 . . . . 10.0 111.446 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -78.07 -24.57 47.63 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.178 -0.919 . . . . 10.0 109.467 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mt -94.61 -25.95 16.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.437 -0.802 . . . . 10.0 109.142 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.1 m -77.64 -45.04 26.23 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.393 -0.822 . . . . 10.0 111.265 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.446 ' SD ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -66.67 -17.24 64.74 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.202 0.525 . . . . 10.0 110.012 179.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -67.12 -30.95 71.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.721 -1.127 . . . . 10.0 109.343 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.25 -54.38 3.08 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.225 -0.898 . . . . 10.0 110.436 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 74.6 mtt180 -28.91 -67.09 0.08 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.237 1.199 . . . . 10.0 114.237 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.435 ' HB2' HD22 ' B' ' 4' ' ' LEU . 16.7 tptt -73.07 -25.58 60.96 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.91 0.337 . . . . 10.0 111.91 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 18.2 ttt -68.86 -36.14 77.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.816 0.341 . . . . 10.0 110.307 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 33.9 mtmt -85.34 -47.88 9.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.608 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -105.26 67.3 0.77 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.98 -0.555 . . . . 10.0 110.416 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.462 HG22 ' SD ' ' A' ' 145' ' ' MET . 0.2 OUTLIER -80.8 -39.24 27.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.21 0.529 . . . . 10.0 110.06 179.744 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -110.75 114.52 27.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.738 -0.665 . . . . 10.0 109.207 178.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 m -138.52 -62.72 0.56 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.777 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -157.17 -63.11 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.701 -0.4 . . . . 10.0 111.205 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -110.39 -4.7 15.46 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.414 0.524 . . . . 10.0 112.414 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.95 -34.5 69.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.033 0.444 . . . . 10.0 110.938 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.6 mt -67.41 -30.83 50.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.568 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -88.68 -25.12 22.53 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 108.073 -1.084 . . . . 10.0 108.073 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.467 ' O ' HG23 ' A' ' 91' ' ' VAL . 61.3 tt0 -61.15 -56.87 15.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.743 -1.117 . . . . 10.0 109.567 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.52 -43.84 96.69 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -59.27 -33.41 71.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.237 0.541 . . . . 10.0 110.149 178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.4 ttp180 -65.46 -29.02 69.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.568 -0.742 . . . . 10.0 110.291 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.1 t -100.64 3.49 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-O 121.172 0.51 . . . . 10.0 110.302 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.4 ' HA ' HG21 ' A' ' 108' ' ' VAL . 3.9 m-85 -117.28 10.0 13.6 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.157 0.503 . . . . 10.0 110.465 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -143.06 153.75 43.26 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.328 -0.851 . . . . 10.0 108.848 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -136.5 -34.42 0.77 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.032 0.444 . . . . 10.0 110.876 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 10.8 p30 -76.28 -25.96 55.44 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.709 -0.396 . . . . 10.0 110.767 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 68.93 74.41 0.62 Allowed Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 110.804 -0.918 . . . . 10.0 110.804 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -133.45 -25.58 1.7 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 -179.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.98 -6.55 29.14 Favored Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.36 -0.924 . . . . 10.0 114.421 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -139.51 142.85 37.25 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 118.9 1.35 . . . . 10.0 110.523 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.39 157.35 42.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.018 0.437 . . . . 10.0 111.653 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.595 ' C ' ' H ' ' A' ' 103' ' ' ALA . 9.4 p -155.19 -135.09 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 108.416 -0.957 . . . . 10.0 108.416 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.66 33.67 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 123.187 1.47 . . . . 10.0 108.616 177.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.595 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -99.56 -110.97 0.18 Allowed 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 111.583 -2.553 . . . . 10.0 110.958 -178.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.598 ' O ' HG23 ' A' ' 108' ' ' VAL . 1.5 mt-10 -64.35 -13.56 51.17 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.564 -0.744 . . . . 10.0 112.826 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.592 HD23 HG13 ' A' ' 121' ' ' VAL . 6.5 tp -67.75 -52.37 38.21 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 120.946 -0.301 . . . . 10.0 111.092 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 106' ' ' ARG . 41.0 ttm180 -48.66 -40.36 27.7 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.866 0.365 . . . . 10.0 111.33 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 43.0 t60 -73.92 -34.27 64.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.985 0.421 . . . . 10.0 110.73 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 104' ' ' GLU . 9.6 t -60.78 -55.88 21.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.703 -0.681 . . . . 10.0 112.637 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.74 -51.48 69.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 19.1 m -51.02 -30.0 14.07 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -94.51 -40.66 9.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.581 0.586 . . . . 10.0 112.581 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.418 ' HG ' HD21 ' A' ' 39' ' ' LEU . 9.4 mt -66.53 -44.59 82.05 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.176 0.436 . . . . 10.0 112.176 -178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 122.72 65.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.026 -1.083 . . . . 10.0 112.902 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.81 148.68 27.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.969 0.414 . . . . 10.0 110.999 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.3 ttpt -88.97 105.62 17.9 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.514 -0.766 . . . . 10.0 109.46 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.509 HD21 ' HD3' ' B' ' 13' ' ' ARG . 1.0 OUTLIER -149.98 104.22 3.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.475 0.546 . . . . 10.0 112.475 -179.23 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.451 ' N ' ' HB2' ' A' ' 120' ' ' GLU . 80.9 p -90.62 175.86 6.88 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 107.997 -1.112 . . . . 10.0 107.997 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -45.58 -46.57 14.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.749 0.648 . . . . 10.0 112.749 178.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -63.52 -22.26 66.79 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-O 121.358 0.599 . . . . 10.0 110.96 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.451 ' HB2' ' N ' ' A' ' 117' ' ' THR . 1.4 mp0 -80.07 -50.98 9.59 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.964 -1.016 . . . . 10.0 109.35 -178.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 105' ' ' LEU . 55.4 t -64.01 -42.36 95.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.843 179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -52.58 -46.98 67.15 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.637 -0.256 . . . . 10.0 110.603 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -51.56 69.06 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.573 0.702 . . . . 10.0 109.466 177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.495 ' SD ' HD21 ' A' ' 105' ' ' LEU . 2.9 ttm -62.32 -15.09 45.91 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 114.872 -1.058 . . . . 10.0 112.368 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 121' ' ' VAL . 21.9 mm -82.18 -48.26 18.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 N-CA-C 108.046 -1.094 . . . . 10.0 108.046 -178.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.1 mtm105 -73.46 -5.29 39.06 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.079 0.942 . . . . 10.0 109.104 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 124' ' ' MET . 6.9 tp10 -82.35 -41.17 20.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 113.66 -1.609 . . . . 10.0 109.641 179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -111.9 4.1 18.02 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 112.992 0.738 . . . . 10.0 112.992 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 26.2 t0 -87.48 52.17 2.42 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.185 0.439 . . . . 10.0 112.185 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 40.0 mm -46.62 -48.16 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -35.52 78.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.825 0.345 . . . . 10.0 110.934 -179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 84.11 56.8 2.49 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 121.03 -0.605 . . . . 10.0 114.218 177.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -127.24 8.99 6.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.24 -1.022 . . . . 10.0 108.24 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.05 53.88 27.59 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 113.847 -1.524 . . . . 10.0 111.403 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -168.39 168.32 11.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.034 0.445 . . . . 10.0 110.549 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 69.3 t -125.64 136.38 61.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 114.929 -1.032 . . . . 10.0 108.955 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 21.8 p-10 -144.39 -177.62 5.57 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.814 -0.439 . . . . 10.0 109.814 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.585 ' O ' HG23 ' A' ' 142' ' ' VAL . 34.9 t80 -61.01 -48.72 80.49 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.217 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -54.23 -34.12 59.94 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.741 0.645 . . . . 10.0 112.741 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -83.49 -47.49 11.3 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.645 -0.252 . . . . 10.0 111.065 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.576 ' CE2' ' CD2' ' B' ' 12' ' ' TYR . 1.5 t80 -56.84 -31.54 64.87 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 112.357 0.503 . . . . 10.0 112.357 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.6 t -49.34 -45.92 18.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 CA-C-O 120.976 0.417 . . . . 10.0 111.298 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -70.24 -42.22 72.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.04 0.447 . . . . 10.0 110.841 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 27.9 mmm -60.67 -42.28 96.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.008 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.462 ' SD ' HG22 ' A' ' 79' ' ' THR . 2.3 mmt -53.04 -23.88 8.54 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 114.188 1.181 . . . . 10.0 114.188 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.5 -32.78 6.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 118.711 0.687 . . . . 10.0 110.863 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-O 120.882 0.372 . . . . 10.0 111.263 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.663 ' HG2' ' SD ' ' A' ' 51' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.293 0 CA-C-O 121.101 0.476 . . . . 10.0 110.368 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . 0.406 ' N ' ' SD ' ' B' ' 1' ' ' MET . 21.5 m-20 -63.08 -24.86 68.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.625 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -40.71 94.78 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 108.924 -0.769 . . . . 10.0 108.924 178.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 75' ' ' LYS . 47.4 mt -76.62 -39.12 53.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' CYS . . . . . . . . . . . . . 9.0 t -63.82 -37.52 87.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.041 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.68 -43.48 97.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 108.939 -0.764 . . . . 10.0 108.939 177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 37.6 t -63.71 -41.24 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.8 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 17.3 m -66.07 -37.45 85.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.019 -0.537 . . . . 10.0 109.841 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 99.1 m -62.59 -36.31 82.32 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.26 -0.644 . . . . 10.0 109.26 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -68.29 -37.16 80.36 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.81 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 8.4 tmtm? -71.09 -35.71 71.93 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.531 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.576 ' CD2' ' CE2' ' A' ' 141' ' ' PHE . 33.3 t80 -74.08 -29.54 61.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.054 0.454 . . . . 10.0 110.793 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.509 ' HD3' HD21 ' A' ' 116' ' ' LEU . 7.0 mmm180 -73.31 -61.86 1.67 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.709 -0.678 . . . . 10.0 111.847 -179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.06 87.08 5.46 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.417 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -113.51 -73.83 0.65 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.96 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -143.87 -55.64 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 N-CA-C 112.068 0.396 . . . . 10.0 112.068 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -87.59 -50.62 6.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.616 -0.265 . . . . 10.0 110.859 -178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 27.0 t0 -77.14 158.76 30.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.898 0.38 . . . . 10.0 110.814 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.6 tp . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.03 0.443 . . . . 10.0 110.421 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.52 133.94 48.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.406 -0.815 . . . . 10.0 111.978 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' ' HB ' ' A' ' 9' ' ' ILE . 17.1 tt0 -49.04 -38.97 25.45 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 114.873 -1.058 . . . . 10.0 109.909 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -55.04 -25.72 32.42 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 113.815 -1.539 . . . . 10.0 111.84 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -128.15 24.03 5.99 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.557 0.694 . . . . 10.0 109.242 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' ' 6' ' ' GLU . 0.4 OUTLIER -58.5 -19.66 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 -176.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -139.8 21.51 2.49 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.385 -0.822 . . . . 10.0 112.329 -177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 14' ' ' GLU . 6.0 tt0 -60.94 -51.09 70.74 Favored 'General case' 0 C--O 1.227 -0.123 0 C-N-CA 120.881 -0.327 . . . . 10.0 110.291 179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -42.79 -49.06 5.77 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.97 0.414 . . . . 10.0 111.121 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -61.89 -39.86 93.4 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.84 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 21.4 mm-40 -59.12 -53.74 54.86 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.011 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.6 -58.15 9.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.397 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.29 -53.52 6.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.941 -1.027 . . . . 10.0 111.306 177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m -55.96 -21.96 23.74 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.818 -1.083 . . . . 10.0 112.926 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.427 HD23 ' CE2' ' A' ' 19' ' ' PHE . 0.8 OUTLIER -91.25 -32.58 15.7 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.065 0.46 . . . . 10.0 111.206 179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.427 ' CE2' HD23 ' A' ' 18' ' ' LEU . 22.9 m-85 -82.56 -61.2 1.95 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.741 -0.663 . . . . 10.0 111.046 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -54.21 168.05 0.26 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 123.108 0.255 . . . . 10.0 110.473 179.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.468 ' HA ' ' HD3' ' A' ' 21' ' ' LYS . 25.9 mmtm -158.5 -42.58 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.649 -1.241 . . . . 10.0 107.649 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -67.57 13.85 0.07 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.756 -1.565 . . . . 10.0 113.097 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 57.59 23.95 51.22 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 116.116 1.206 . . . . 10.0 116.116 177.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -100.7 -38.97 8.08 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 118.572 1.186 . . . . 10.0 108.485 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 93.04 32.39 7.93 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 113.458 -1.701 . . . . 10.0 115.39 178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 48.9 p -142.8 125.58 16.02 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 106.919 -1.511 . . . . 10.0 106.919 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -76.96 115.86 19.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 C-N-CA 121.073 -0.251 . . . . 10.0 111.195 -177.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -97.59 -174.22 2.85 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 110.426 -0.213 . . . . 10.0 110.426 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -57.18 -55.26 37.01 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.268 -0.424 . . . . 10.0 111.778 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.9 tttt -62.13 -32.17 72.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.356 0.502 . . . . 10.0 112.356 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -76.01 -37.52 58.34 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.661 -0.416 . . . . 10.0 110.457 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.33 -35.71 81.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.907 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.92 -29.7 64.61 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.954 -0.641 . . . . 10.0 113.837 -179.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -65.79 -49.48 68.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.605 0.703 . . . . 10.0 110.477 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 t -56.9 -45.61 83.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 114.895 -1.048 . . . . 10.0 109.531 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.458 ' HG2' ' HB2' ' A' ' 41' ' ' GLN . 7.0 ttt -64.33 -40.26 95.53 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.733 -1.121 . . . . 10.0 110.925 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.634 ' HA ' ' O ' ' A' ' 41' ' ' GLN . 49.2 ttp180 -64.49 -37.35 87.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.471 -0.786 . . . . 10.0 110.923 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 56.0 m -61.73 -21.56 64.62 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.173 0.511 . . . . 10.0 110.366 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 36' ' ' MET . 62.5 mt -81.46 -12.04 59.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.366 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.38 -11.73 23.85 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.692 -0.766 . . . . 10.0 112.524 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 37' ' ' ARG . 66.1 mm-40 -80.72 160.58 24.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.766 0.317 . . . . 10.0 111.819 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -164.65 80.99 1.3 Allowed Pre-proline 0 C--O 1.236 0.361 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.686 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -94.11 -179.87 0.8 Allowed 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.48 2.787 . . . . 10.0 113.196 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.6 p -85.57 178.45 7.39 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.716 -0.674 . . . . 10.0 110.666 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.0 -41.62 90.81 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.926 0.343 . . . . 10.0 111.926 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 50' ' ' ASP . . . -66.67 -29.2 69.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.503 0.668 . . . . 10.0 110.391 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -77.76 -25.02 48.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.148 -0.933 . . . . 10.0 110.226 179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.9 mt -83.51 -48.46 10.25 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.598 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -62.58 -30.86 71.63 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.911 0.386 . . . . 10.0 110.687 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 46' ' ' ALA . 13.2 t70 -57.21 -32.69 66.76 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.868 178.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.739 ' O ' ' HB3' ' A' ' 54' ' ' GLU . 33.4 mmt -68.2 -42.41 79.92 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.2 -0.909 . . . . 10.0 110.797 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 36.6 mm -48.44 -52.25 8.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 O-C-N 121.948 -0.47 . . . . 10.0 109.819 175.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.17 -30.6 17.28 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.75 -1.114 . . . . 10.0 110.945 178.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.739 ' HB3' ' O ' ' A' ' 51' ' ' MET . 21.3 tt0 -60.57 -37.37 81.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 114.645 -1.162 . . . . 10.0 111.399 179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.582 HG12 ' HB3' ' A' ' 67' ' ' GLU . 18.9 t -107.42 -42.94 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 N-CA-C 112.56 0.578 . . . . 10.0 112.56 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HA ' ' CD ' ' A' ' 67' ' ' GLU . 14.2 t70 -58.36 129.92 44.29 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.125 0.488 . . . . 10.0 111.904 -178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -139.88 3.0 2.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.342 -0.845 . . . . 10.0 110.397 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 60' ' ' ASN . 0.8 OUTLIER -97.28 -8.82 28.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.595 -0.275 . . . . 10.0 110.931 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.09 15.21 75.27 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.688 -0.767 . . . . 10.0 114.256 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.507 ' HB3' ' OD1' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -88.47 -25.17 22.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 117.447 0.623 . . . . 10.0 110.045 179.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 89.9 28.02 19.7 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.071 -0.585 . . . . 10.0 114.303 178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.31 141.78 5.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.432 0.616 . . . . 10.0 110.871 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 3.1 mt -64.37 124.8 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 0.4 OUTLIER -113.25 -148.11 0.43 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 -178.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' H ' ' HB2' ' A' ' 64' ' ' ASP . 24.5 t80 -85.34 -45.93 0.63 Allowed Pre-proline 0 CA--C 1.541 0.62 0 O-C-N 121.857 -0.527 . . . . 10.0 111.587 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 64' ' ' ASP . 32.5 Cg_exo -55.12 -50.42 13.16 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.801 1.667 . . . . 10.0 111.185 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.582 ' HB3' HG12 ' A' ' 55' ' ' VAL . 23.3 mt-10 -60.81 -16.64 43.06 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.587 0.708 . . . . 10.0 111.046 178.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -26.81 30.67 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.989 178.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 72' ' ' MET . 55.2 mt -95.97 -32.69 12.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.333 0.587 . . . . 10.0 111.212 -179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -71.83 -39.47 69.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.902 -0.59 . . . . 10.0 111.043 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . 0.471 ' HA ' ' HB2' ' A' ' 74' ' ' ARG . 1.5 ttp -72.8 -10.22 59.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.452 0.644 . . . . 10.0 109.798 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.517 ' HB3' ' O ' ' A' ' 69' ' ' LEU . 11.4 tmm? -67.1 -37.39 83.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.968 -1.015 . . . . 10.0 109.658 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.56 -52.36 4.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.664 -0.698 . . . . 10.0 109.905 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' A' ' 71' ' ' MET . 64.5 mtt180 -39.0 -59.64 0.96 Allowed 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 112.907 0.706 . . . . 10.0 112.907 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.77 ' HB3' HG11 ' B' ' 7' ' ' VAL . 11.9 tptt -75.84 -6.74 52.2 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -177.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 19.0 ttt -90.04 -37.62 14.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.11 0.481 . . . . 10.0 109.941 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -92.93 -20.78 20.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.042 -0.526 . . . . 10.0 111.12 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.447 ' HB2' ' O ' ' A' ' 74' ' ' ARG . 0.2 OUTLIER -103.85 44.59 1.01 Allowed 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 178.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.4 HG21 ' HD2' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -67.41 -33.25 74.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.184 -0.916 . . . . 10.0 112.758 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -127.89 133.77 49.33 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.278 -0.569 . . . . 10.0 110.519 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -151.39 -56.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.493 -0.776 . . . . 10.0 110.348 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -168.09 -60.07 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.12 0.485 . . . . 10.0 111.425 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -114.36 4.32 15.33 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.357 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -59.66 -45.35 92.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.425 0.631 . . . . 10.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.605 HG23 ' HG3' ' A' ' 145' ' ' MET . 35.6 mt -77.69 -10.59 13.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.317 -0.856 . . . . 10.0 110.623 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -91.69 -30.4 16.32 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.674 -1.232 . . . . 10.0 107.674 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 91' ' ' VAL . 1.7 tp10 -62.49 -53.61 52.3 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.664 -1.153 . . . . 10.0 107.947 178.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.525 ' CB ' HG21 ' B' ' 8' ' ' THR . . . -61.42 -43.94 97.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.361 -1.291 . . . . 10.0 111.145 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -58.49 -38.81 78.41 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.945 -0.57 . . . . 10.0 109.876 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 26.7 ttp180 -66.86 -25.44 66.41 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.74 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 87' ' ' GLU . 2.2 t -98.84 4.99 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.468 0.651 . . . . 10.0 109.579 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.475 ' O ' HG21 ' A' ' 100' ' ' ILE . 1.2 m-85 -117.0 14.97 15.13 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.177 -1.416 . . . . 10.0 107.177 177.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -139.53 151.81 46.41 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 113.677 -1.601 . . . . 10.0 109.584 -178.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -140.62 -31.08 0.63 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.782 0.325 . . . . 10.0 110.307 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -87.71 -32.28 19.26 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 -178.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.51 74.65 1.07 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.185 -1.007 . . . . 10.0 111.227 -179.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -131.9 -27.27 1.88 Allowed 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 122.545 -0.385 . . . . 10.0 109.973 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 112.15 -13.28 26.3 Favored Glycine 0 CA--C 1.521 0.46 0 C-N-CA 120.817 -0.706 . . . . 10.0 113.832 179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.61 150.27 41.78 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 117.907 0.853 . . . . 10.0 110.964 -178.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.586 HG22 ' OE1' ' A' ' 104' ' ' GLU . 8.0 pt -132.99 164.2 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 CA-C-O 121.103 0.477 . . . . 10.0 112.011 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.605 ' C ' ' H ' ' A' ' 103' ' ' ALA . 5.4 p -163.46 -122.31 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 177.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.28 36.32 0.41 Allowed 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 123.561 1.648 . . . . 10.0 108.324 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' A' ' 101' ' ' SER . . . -102.66 -112.25 0.22 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 111.527 -2.579 . . . . 10.0 110.795 -178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.586 ' OE1' HG22 ' A' ' 100' ' ' ILE . 1.5 mt-10 -69.28 -6.95 32.68 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.556 -0.747 . . . . 10.0 112.988 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 100' ' ' ILE . 2.9 tp -68.73 -61.35 1.85 Allowed 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 119.853 -0.739 . . . . 10.0 110.161 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 -47.79 -51.22 23.33 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.51 0.506 . . . . 10.0 111.504 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -60.5 -38.96 86.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.029 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 2.2 t -66.1 -48.42 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.243 0.461 . . . . 10.0 112.243 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.856 ' HG2' HD12 ' A' ' 116' ' ' LEU . 1.1 mpt? -64.98 -46.74 80.23 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.995 -0.282 . . . . 10.0 110.615 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 93.2 m -52.44 -40.01 61.72 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.178 -0.464 . . . . 10.0 111.461 178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -80.69 -7.1 59.22 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.68 -3.85 23.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.557 -0.292 . . . . 10.0 111.29 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 81.69 15.92 74.42 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 119.528 -1.32 . . . . 10.0 112.819 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.35 159.21 16.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.999 0.428 . . . . 10.0 111.078 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.41 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 1.2 tmtt? -107.44 116.34 31.77 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.044 -0.526 . . . . 10.0 109.722 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.856 HD12 ' HG2' ' A' ' 109' ' ' MET . 13.0 mt -162.12 93.47 0.88 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.575 -0.284 . . . . 10.0 110.879 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.8 p -82.62 173.62 11.77 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -41.28 -58.87 1.7 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.114 1.524 . . . . 10.0 115.114 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -21.03 64.97 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.982 0.896 . . . . 10.0 111.39 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.496 ' HB3' HD23 ' A' ' 116' ' ' LEU . 2.5 mt-10 -82.04 -46.17 14.29 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.304 -1.316 . . . . 10.0 108.64 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.1 -34.89 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 176.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -51.9 -51.38 57.25 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.222 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.494 ' HA ' ' NH2' ' A' ' 126' ' ' ARG . 0.3 OUTLIER -55.97 -47.23 78.03 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.371 178.569 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.552 ' SD ' ' HE1' ' B' ' 12' ' ' TYR . 3.1 ttm -60.73 -21.78 63.32 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-N 114.789 -1.096 . . . . 10.0 112.757 179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 129' ' ' ASP . 22.3 mm -78.24 -44.17 27.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.677 0 N-CA-C 107.2 -1.407 . . . . 10.0 107.2 -179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.494 ' NH2' ' HA ' ' A' ' 123' ' ' GLU . 26.4 mtm105 -71.54 -7.34 47.02 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.735 0.779 . . . . 10.0 109.183 177.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.465 ' HB3' ' O ' ' A' ' 124' ' ' MET . 4.8 tp10 -79.13 -38.68 35.48 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.359 -1.291 . . . . 10.0 109.595 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.48 3.13 13.2 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.44 0.904 . . . . 10.0 113.44 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 125' ' ' ILE . 25.3 t0 -88.25 51.3 2.16 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.638 0.607 . . . . 10.0 112.638 -177.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 7.2 mm -43.98 -50.08 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 112.922 0.712 . . . . 10.0 112.922 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -32.71 72.5 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.046 0.451 . . . . 10.0 111.21 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.408 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 77.64 67.05 1.69 Allowed Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.8 -0.637 . . . . 10.0 113.436 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.463 ' OD2' ' HB2' ' A' ' 135' ' ' GLN . 0.4 OUTLIER -136.22 10.41 3.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.669 -1.234 . . . . 10.0 107.669 177.417 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.51 47.63 87.91 Favored Glycine 0 N--CA 1.445 -0.731 0 CA-C-N 113.452 -1.703 . . . . 10.0 111.471 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.463 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 64.5 mm-40 -155.81 162.6 40.45 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 -178.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.539 ' HB ' HG13 ' A' ' 100' ' ' ILE . 98.8 t -124.62 129.87 73.6 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -136.35 176.82 8.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 -179.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.476 ' O ' HG23 ' A' ' 142' ' ' VAL . 89.6 t80 -58.82 -48.1 82.49 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.062 0.226 . . . . 10.0 110.535 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -54.5 -33.02 59.1 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.85 -0.614 . . . . 10.0 111.991 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -86.91 -45.52 10.75 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 120.685 0.278 . . . . 10.0 110.879 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.7 ' HE2' ' CD2' ' B' ' 12' ' ' TYR . 2.3 t80 -57.76 -34.31 69.42 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.566 ' HA ' HD13 ' A' ' 85' ' ' ILE . 47.9 t -53.67 -57.16 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 120.846 -0.342 . . . . 10.0 110.64 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -60.64 -47.71 85.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.869 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.83 -35.86 75.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.951 -0.568 . . . . 10.0 111.191 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' MET . . . . . 0.605 ' HG3' HG23 ' A' ' 85' ' ' ILE . 29.0 mmm -74.11 -6.08 45.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 112.816 0.672 . . . . 10.0 112.816 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.54 -32.52 6.66 Favored 'General case' 0 C--O 1.235 0.316 0 O-C-N 121.622 -0.674 . . . . 10.0 110.217 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.062 -179.274 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.54 ' N ' HD23 ' B' ' 4' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.236 0.356 0 CA-C-O 120.828 0.346 . . . . 10.0 111.161 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . 0.553 ' HA ' ' SG ' ' B' ' 5' ' ' CYS . 1.5 p30 -57.21 -37.18 71.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 116.052 -0.522 . . . . 10.0 112.153 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' CYS . . . . . . . . . . . . . 4.0 m -54.25 -49.08 70.33 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.154 0.433 . . . . 10.0 111.104 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.546 ' HG ' ' N ' ' B' ' 5' ' ' CYS . 0.1 OUTLIER -74.36 -35.77 63.55 Favored 'General case' 0 N--CA 1.467 0.391 0 O-C-N 122.19 -0.319 . . . . 10.0 110.98 -179.504 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' B' ' 2' ' ' ASP . 0.7 OUTLIER -69.38 -32.65 71.82 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.102 -0.639 . . . . 10.0 109.944 -179.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ILE . . . . . 0.468 HD13 ' HA ' ' B' ' 6' ' ' ILE . 2.6 mm -64.89 -46.3 92.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.77 HG11 ' HB3' ' A' ' 75' ' ' LYS . 77.1 t -64.12 -43.77 97.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.649 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . 0.582 HG23 ' SD ' ' A' ' 145' ' ' MET . 62.6 m -68.62 -39.46 80.8 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.478 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 53.0 m -62.31 -38.16 88.35 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -63.65 -37.09 86.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.804 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.518 ' HE3' ' O ' ' A' ' 145' ' ' MET . 34.9 tttm -70.86 -50.08 39.06 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.671 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.7 ' CD2' ' HE2' ' A' ' 141' ' ' PHE . 87.6 t80 -61.43 -22.5 65.08 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.443 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.756 ' HD3' HD11 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -82.2 -61.59 1.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 10.0 111.228 -179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -87.44 92.82 9.22 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.73 -179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' B' ' 11' ' ' LYS . 12.1 mm100 -125.6 -56.58 1.49 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.569 -0.287 . . . . 10.0 111.004 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -160.66 -54.25 0.05 Allowed 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.211 -0.595 . . . . 10.0 112.331 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -84.45 -53.21 5.59 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ASP . . . . . 0.437 ' OD1' ' HD2' ' B' ' 13' ' ' ARG . 25.8 t0 -79.99 162.59 24.81 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.977 0.418 . . . . 10.0 111.347 -179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_