data_2ruq_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 2ruq _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.237 0.43 0 N-CA-C 112.951 0.327 . . . . 63.34 112.951 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 65.33 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.11 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.24 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.03 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 53.54 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.562 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.43 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.47 HD21 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.12 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.21 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.13 110.555 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.44 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 65.35 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.401 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.15 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.419 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.11 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.473 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.03 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.462 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.04 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.01 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.23 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.34 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.23 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.44 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.52 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.45 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.05 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 75.12 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.437 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.23 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.1 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.04 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.23 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.23 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 75.24 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.32 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.03 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.02 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.34 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.14 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 74.4 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.55 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.32 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.4 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.22 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.524 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.02 111.606 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.41 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.03 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.43 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.24 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.42 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.13 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.3 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.32 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.02 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.492 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.3 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.11 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.44 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.41 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.4 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 62.33 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.32 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.23 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.42 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.24 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.448 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.32 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 73.44 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.01 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.41 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.32 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.557 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.44 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.35 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.13 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.33 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.43 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.35 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.1 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.51 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.21 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.14 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.14 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.54 110.122 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.404 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.23 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.21 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.583 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.4 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.404 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.04 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.12 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.13 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.23 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.442 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.52 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.34 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.14 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.442 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.4 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.21 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.54 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.42 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.01 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.35 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.34 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.44 109.754 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.53 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.473 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 74.51 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.14 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 74.42 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.562 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 72.34 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.02 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.1 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.3 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 75.14 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.24 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.34 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 C--O 1.231 0.154 0 N-CA-C 111.138 -0.37 . . . . 72.35 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.21 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.11 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.44 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.41 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 73.12 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.12 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.612 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.11 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.42 ' HB2' ' CE1' ' A' ' 111' ' ' HIS . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.43 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.2 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.415 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.2 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 62.12 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.33 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.44 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 72.24 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.13 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.436 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.43 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 62.54 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.32 109.292 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 73.44 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.11 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.34 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.2 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.12 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.488 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.31 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.14 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.488 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.53 111.122 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.04 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.24 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.14 109.866 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 75.53 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.11 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 72.41 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 74.23 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.34 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.537 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 74.0 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.21 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.513 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 70.23 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 64.21 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 74.42 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.13 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.55 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.41 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.21 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 74.44 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.42 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.31 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.43 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.429 HD11 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.24 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.15 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.15 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.23 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.44 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.41 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.42 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.41 110.591 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.13 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.21 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.45 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.42 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.33 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.43 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.34 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 71.22 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.32 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.55 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 64.34 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.4 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.44 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.14 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.11 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.04 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.497 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.41 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.02 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.608 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 71.04 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.55 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.33 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.43 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.33 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 75.04 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.2 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 74.13 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.32 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.54 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.53 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.44 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.41 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.33 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 62.11 110.555 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.33 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.43 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 73.12 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 111' ' ' HIS . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.24 110.235 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.13 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.35 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.34 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.45 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.612 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 53.3 m-70 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 74.5 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.11 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.608 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.4 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.33 109.328 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 61.41 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 72.43 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HA ' HG22 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.03 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 C--O 1.237 0.446 0 CA-C-O 121.098 0.374 . . . . 72.22 112.865 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.32 110.893 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 70.1 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.23 110.352 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.539 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.11 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.553 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.34 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.45 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.54 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.484 HD22 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.45 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' N ' HD22 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 72.23 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.52 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.32 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.43 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.1 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.42 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 73.0 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 73.55 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 72.11 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 72.31 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.23 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.435 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.21 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.453 ' NE ' ' HA ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.43 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.412 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.23 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.14 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.22 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.42 109.251 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 73.12 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.41 110.282 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.41 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.22 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.54 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.51 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.01 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.42 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.41 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.3 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.12 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.504 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.42 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.32 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.4 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.2 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.33 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.3 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.33 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.41 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 58' ' ' GLU . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.24 110.923 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.23 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HB2' ' OD2' ' A' ' 56' ' ' ASP . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.43 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.24 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 75.02 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.42 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.14 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.22 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 70.14 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.41 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.2 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.426 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 50.34 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.13 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.43 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.31 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.33 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 63.23 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.34 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.23 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.44 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.51 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.42 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.11 110.61 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.44 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.43 111.175 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.44 111.418 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.506 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.32 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.12 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.04 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.31 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 73.41 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 74.11 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.3 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.24 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.54 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.21 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.553 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.32 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 75.44 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.45 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.12 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.23 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 116' ' ' THR . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.04 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.43 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.42 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.42 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.509 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.11 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.04 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.45 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.21 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 72.45 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.41 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.21 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 64.43 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.44 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.52 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.432 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 73.53 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.509 ' HB ' ' OG ' ' A' ' 101' ' ' SER . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.11 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 75.14 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 74.32 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.43 ' O ' HG22 ' A' ' 97' ' ' THR . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.53 110.481 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.445 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo . . . . . 0 C--O 1.238 0.511 0 CA-C-O 120.927 0.303 . . . . 55.24 112.255 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.15 110.104 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.23 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 72.44 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 72.33 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.35 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.24 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.478 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.3 p80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 73.24 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.34 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.14 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.411 ' CG1' HD12 ' A' ' 43' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.1 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.41 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 74.45 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.34 111.165 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.34 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.34 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 72.22 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.54 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.11 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.465 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.03 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 71.53 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.52 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.33 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 72.32 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.14 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 62.34 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.45 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.31 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.432 HG23 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 74.22 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.13 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.45 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' HG23 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.53 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 63.05 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.03 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.03 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 74.23 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.43 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 71.54 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.02 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 74.24 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.45 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.01 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.01 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.55 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.45 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.34 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.43 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.22 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.32 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.33 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.13 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.12 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.41 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.21 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.42 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.44 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.32 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.43 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.04 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.3 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.44 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.02 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.52 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.478 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.53 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.23 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 73.02 110.119 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.24 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.23 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 65.12 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.33 110.638 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.32 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.429 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.14 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.41 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.44 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.24 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.13 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.31 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 75.22 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.23 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.05 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.59 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.24 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.532 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 75.41 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.42 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.3 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.43 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.11 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.51 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.44 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.14 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.42 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.44 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.03 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.12 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 73.12 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.11 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.43 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.33 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.42 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.406 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.12 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.44 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.3 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 63.33 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.24 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.22 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.31 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo . . . . . 0 C--O 1.236 0.422 0 N-CA-C 111.493 -0.233 . . . . 53.35 111.493 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.24 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.31 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.43 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.53 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 65.24 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 65.53 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.542 ' ND1' HD13 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.2 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.13 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.552 HD11 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.43 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.548 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.54 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.467 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.14 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.02 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.467 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.22 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.43 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.44 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.11 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.12 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.53 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.41 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.33 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.32 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.54 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.42 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.43 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.44 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.14 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.14 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.3 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.03 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.13 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.31 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.33 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.32 111.087 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.33 109.501 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.31 110.928 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.03 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.23 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.449 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.03 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.13 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.54 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.506 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.13 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.11 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.11 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.13 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.506 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 75.32 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.11 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.21 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.14 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.54 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.52 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.24 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.464 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.13 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.3 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 74.24 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.11 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.22 111.995 -176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.03 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.433 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.42 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 74.43 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.03 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.03 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.464 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.41 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.53 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.502 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 72.4 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.542 HD13 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 54.42 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.1 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.44 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.41 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.1 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.43 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.478 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.1 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.22 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.44 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.457 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.11 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.13 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.02 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.478 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.45 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.41 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.12 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.55 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.05 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.22 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.3 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.05 110.726 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.11 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.33 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.487 ' SD ' HG23 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.44 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.01 110.544 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.24 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.12 112.041 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.499 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.44 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.24 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.13 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.11 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.33 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.05 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.51 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 70.34 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.45 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.21 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.13 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.44 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 75.33 110.137 179.286 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.469 0.081 0 CA-C-O 120.878 0.282 . . . . 70.11 112.339 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.22 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 73.43 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.23 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.22 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 74.1 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.24 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.498 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.44 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.15 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.415 ' N ' HD22 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.12 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 72.34 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.14 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.02 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 74.41 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.52 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.43 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 73.02 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.23 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.52 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.3 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.44 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.22 111.205 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.11 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.24 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.23 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.42 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 73.03 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.23 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 75.42 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.2 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.4 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 70.11 110.268 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.02 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.54 109.483 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.577 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.23 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.53 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.03 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.424 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.43 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.52 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.34 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.14 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.13 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.34 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.3 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.15 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.41 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.1 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.43 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.41 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.21 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.15 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.21 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.51 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.468 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.14 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.53 111.857 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.424 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 75.34 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.3 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.41 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.42 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.45 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.04 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.468 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.53 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.51 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.4 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.23 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.42 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.54 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.15 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.42 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 71.23 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.24 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.32 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.11 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.12 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.673 -177.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.24 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.14 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.3 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 75.34 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.12 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.51 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.12 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.34 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.34 111.247 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 64.03 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.1 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.32 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 65.51 109.302 176.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.11 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.31 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 73.41 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.413 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 61.4 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.11 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.34 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.51 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.03 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.43 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.12 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.13 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.42 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.42 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.498 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.31 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.452 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.11 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.02 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.45 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.11 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.23 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo . . . . . 0 N--CA 1.46 -0.462 0 N-CA-C 110.915 -0.456 . . . . 75.33 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.21 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.4 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.24 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.43 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.22 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.21 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.415 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 74.31 112.881 -175.036 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.44 HD22 HD13 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.54 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.21 111.156 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.23 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.12 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 54.51 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.22 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 65.54 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.42 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.35 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.13 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.41 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 75.4 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.33 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.54 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.12 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.22 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.12 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.12 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.11 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.12 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.434 HG23 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 74.14 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.22 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.2 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.42 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.14 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.15 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.41 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 74.22 111.047 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.4 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.13 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.413 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 74.11 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.23 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.22 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.42 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.34 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 71.11 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.33 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.12 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.44 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.34 111.723 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.53 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.14 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.407 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.53 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.42 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.23 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.01 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.13 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.407 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 74.21 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.14 108.264 175.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.11 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.04 112.383 -176.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.21 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 74.01 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.23 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.53 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.01 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.415 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.44 112.636 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 63.53 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.501 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.11 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.31 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 73.32 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 73.41 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.31 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.41 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.451 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.33 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.35 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.23 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.11 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.451 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.32 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.2 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 63.31 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.21 111.401 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.22 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 72.15 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.14 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.24 111.457 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 71.12 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.31 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.43 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 73.01 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.3 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.55 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.44 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.33 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.14 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.14 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.22 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.43 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 75.23 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.31 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.01 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.24 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.44 HD13 HD22 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 73.41 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.45 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 62.33 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.54 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.03 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.33 110.388 -179.244 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD2' ' CE2' ' A' ' 93' ' ' PHE . 8.8 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 111.292 -0.311 . . . . 65.12 111.292 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.13 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.44 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.2 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.51 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.14 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 73.21 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 75.15 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.42 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.42 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 62.4 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.33 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.11 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.12 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.11 110.741 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.22 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 72.22 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.24 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.45 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.41 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.41 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.31 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.3 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 71.23 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 61.41 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.31 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.41 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.22 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.01 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.41 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.12 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.41 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.41 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 74.52 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.11 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.23 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.02 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.42 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.15 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.55 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.15 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.35 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.409 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.24 110.111 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.31 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.14 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.51 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 46' ' ' TYR . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.3 111.763 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.31 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.1 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.1 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.52 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.41 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 73.13 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.34 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.14 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 54.13 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.54 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.44 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.554 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 61.12 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.01 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 72.22 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 65.23 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.557 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.05 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.45 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.44 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.14 110.749 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 73.14 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.03 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.554 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 75.41 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.23 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.13 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.43 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.44 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 75.25 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.21 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.42 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.52 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.41 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.43 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.3 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.4 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.31 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.55 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.568 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.31 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 74.33 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.455 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.11 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.41 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.44 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.13 109.797 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.14 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.43 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.21 110.416 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.02 110.997 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.1 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.12 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.41 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.14 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.45 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 60.43 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.43 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 73.04 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.52 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.44 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 73.01 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.42 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.34 108.843 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.2 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 74.04 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 60.21 110.245 -179.097 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 120.801 0.25 . . . . 70.23 111.859 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.04 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.02 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.23 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.1 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 74.01 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.43 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.03 112.115 -176.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.54 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.12 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.43 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.57 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.31 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.22 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 64.41 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.3 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 75.45 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.43 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 73.35 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.1 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.4 ' HB2' HD13 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.1 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.12 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.32 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.13 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.53 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.05 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.24 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 61.05 110.503 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.42 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.12 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.33 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.533 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.43 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.31 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.2 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.33 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.14 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.44 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.02 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.31 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.42 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.01 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.31 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 74.32 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.1 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.41 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.21 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.13 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.43 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.14 111.252 -179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 63.22 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.3 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.44 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.44 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.14 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.22 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.422 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 75.44 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 73.14 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.419 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.12 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 75.32 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.42 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.42 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.4 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.31 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.04 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.31 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.53 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.22 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.22 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 55.13 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.24 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.23 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.44 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.437 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.14 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.01 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.42 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.33 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 74.44 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.32 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.3 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.21 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . 0.41 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.12 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.52 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.42 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.42 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 74.22 110.423 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 74.44 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.35 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.35 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.44 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.04 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.24 110.585 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.54 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.52 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.55 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.55 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.3 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.42 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.54 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.22 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.31 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.31 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.41 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 41.13 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 C--O 1.237 0.465 0 CA-C-O 121.166 0.402 . . . . 74.31 112.683 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 74.02 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 75.12 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.01 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.53 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.42 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 70.11 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.45 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.6 OUTLIER -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 71.11 112.066 -177.573 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.11 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.2 110.921 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.31 108.689 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.22 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.21 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.51 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.14 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.33 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.31 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.53 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.48 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.55 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.52 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.04 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.03 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.42 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.31 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.21 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.24 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.54 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.4 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.53 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.2 110.199 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.44 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.42 110.297 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.543 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.54 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.54 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 74.24 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.14 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.543 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.21 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.622 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 74.32 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.53 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 75.1 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.31 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.41 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 54.42 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.54 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.24 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.11 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.01 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.21 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.42 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.02 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.43 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.31 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.12 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 75.54 112.998 -178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.34 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.02 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.43 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.42 111.628 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.04 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.15 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.13 111.78 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.42 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.12 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.12 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.428 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.13 112.978 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.22 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.43 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.05 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.44 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.54 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.34 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.45 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.51 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.14 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.48 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 74.2 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.48 ' H ' ' HG3' ' A' ' 84' ' ' MET . 15.7 mm100 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.51 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.24 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.41 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.21 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.12 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.1 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.1 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.45 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.22 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.52 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.33 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.35 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.43 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.15 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.02 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.44 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.13 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.44 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.31 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.52 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.14 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.24 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.23 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.14 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.15 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 75.52 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.14 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.52 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.02 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.23 110.178 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.156 0 N-CA-C 111.738 -0.545 . . . . 62.21 111.738 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -84.03 -45.91 12.58 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.758 0.313 . . . . 71.25 110.502 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -109.41 151.13 27.07 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.067 -0.253 . . . . 74.52 110.578 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.5 mtm -97.49 -174.65 2.98 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.673 -0.492 . . . . 71.1 109.673 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.15 128.08 93.45 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.513 -0.551 . . . . 72.32 109.513 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.91 118.04 3.53 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.012 2.474 . . . . 63.34 112.951 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 65.33 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.11 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.24 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.03 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.458 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 53.54 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.562 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.43 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.47 HD21 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.12 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.21 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.13 110.555 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.44 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 65.35 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.401 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.15 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.419 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.11 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.473 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.03 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.462 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.04 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.01 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.462 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 74.24 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.23 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.34 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.23 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.44 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.52 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.45 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.05 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 75.12 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.437 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.23 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.1 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.04 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.23 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.23 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 75.24 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.32 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.03 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.02 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.576 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.34 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.14 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 74.4 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.55 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.32 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.4 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.22 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.524 ' HB3' ' HZ2' ' A' ' 51' ' ' LYS . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.02 111.606 -179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.41 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.03 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.43 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.24 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.42 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.13 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.3 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.32 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.02 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.492 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.3 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.11 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.44 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.41 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.4 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 62.33 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.32 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.23 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.42 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.24 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.448 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.32 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 73.44 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.01 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.41 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.32 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.557 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.44 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.35 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.13 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.33 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.43 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.35 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.1 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.51 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.21 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.14 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.14 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.54 110.122 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.23 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.21 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.583 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.4 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.404 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.04 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.12 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.13 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.23 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.442 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.52 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.34 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.14 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.442 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.4 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.21 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.54 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.42 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.01 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.35 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.477 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.34 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.44 109.754 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.53 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.473 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 74.51 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.14 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.477 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 74.42 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.562 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 72.34 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.02 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.1 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.3 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 75.14 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.24 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.34 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.405 0 N-CA-C 111.707 -0.557 . . . . 73.13 111.707 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 m -99.5 134.16 42.77 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.872 0.367 . . . . 64.24 111.055 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -154.61 132.78 11.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.083 -0.508 . . . . 74.12 110.414 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.448 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 46.1 ttm -113.34 148.32 35.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.141 -0.481 . . . . 70.11 110.246 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.448 ' HB3' ' O ' ' A' ' 4' ' ' MET . 42.0 tt0 73.46 138.07 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.557 0 O-C-N 123.858 0.724 . . . . 64.21 111.271 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.58 116.81 3.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.519 2.146 . . . . 72.35 111.138 177.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.21 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.11 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.44 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.41 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 73.12 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.12 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.612 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.11 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.42 ' HB2' ' CE1' ' A' ' 111' ' ' HIS . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.43 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.2 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.415 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.2 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 62.12 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.33 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.44 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 72.24 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.13 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.436 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.43 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 62.54 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.32 109.292 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 73.44 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.11 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.465 ' HB2' HD12 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.34 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.2 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.12 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.488 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.31 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.14 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.488 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.53 111.122 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.04 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.24 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.14 109.866 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.475 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 75.53 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.11 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 72.41 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 74.23 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.34 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.537 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 74.0 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.21 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.513 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 70.23 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 64.21 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 74.42 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.13 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.55 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.41 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.21 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD11 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 74.44 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.42 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.438 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.31 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.43 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.429 HD11 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.24 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.15 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.15 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.23 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.44 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.41 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.415 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.42 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.41 110.591 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.13 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.21 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.45 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.42 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.33 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.43 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.34 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 71.22 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.32 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.55 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 64.34 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.4 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.44 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.14 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.11 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.04 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.497 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.41 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.02 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.608 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 71.04 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.55 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.33 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.43 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.33 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 75.04 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.2 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 74.13 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.32 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.402 HG22 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.54 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.53 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.44 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.41 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.33 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 62.11 110.555 -179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.33 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.43 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 73.12 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 111' ' ' HIS . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.24 110.235 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.13 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.35 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.34 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.45 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.612 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 53.3 m-70 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 74.5 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.11 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.608 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.4 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.33 109.328 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 61.41 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 72.43 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HA ' HG22 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.03 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 112.056 -0.418 . . . . 72.15 112.056 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 m -76.24 141.5 41.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.921 0.391 . . . . 73.54 111.289 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -149.36 22.81 0.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.979 -0.555 . . . . 74.34 110.482 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.3 mtp -132.36 169.33 16.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.926 -0.579 . . . . 72.14 110.553 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -82.07 126.9 73.67 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.438 -0.346 . . . . 71.53 110.303 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.9 161.46 36.41 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.048 2.499 . . . . 72.22 112.865 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.32 110.893 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 70.1 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.23 110.352 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.539 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.11 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.553 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.34 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.45 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.54 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.484 HD22 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.45 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' N ' HD22 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 72.23 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.52 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.32 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.43 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.1 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.42 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 73.0 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 73.55 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 72.11 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 72.31 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.23 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.435 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.21 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.453 ' NE ' ' HA ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.43 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.412 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.23 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.14 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.22 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.42 109.251 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 73.12 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.41 110.282 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.41 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.22 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.54 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.51 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.01 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.42 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.41 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.3 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.12 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.504 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.42 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.32 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.4 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.2 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.33 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.3 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.33 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.41 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 58' ' ' GLU . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.24 110.923 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.23 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HB2' ' OD2' ' A' ' 56' ' ' ASP . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.43 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.24 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 75.02 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.42 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.14 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.22 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 70.14 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.41 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.2 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.426 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 50.34 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.13 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.43 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.31 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.33 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 63.23 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.34 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.23 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.44 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.51 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.539 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.42 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.11 110.61 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.44 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.43 111.175 -178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.44 111.418 178.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.506 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.32 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.12 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.04 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.31 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 73.41 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 74.11 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.3 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.506 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.24 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.54 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.626 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.21 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.553 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.32 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 75.44 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.45 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.12 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.23 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 116' ' ' THR . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.04 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.43 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.42 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.42 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.509 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.11 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.04 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.45 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.21 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 72.45 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.41 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.21 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 64.43 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.44 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.52 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.432 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 73.53 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.509 ' HB ' ' OG ' ' A' ' 101' ' ' SER . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.11 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 75.14 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 74.32 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.43 ' O ' HG22 ' A' ' 97' ' ' THR . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.53 110.481 -179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.473 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.223 0 N-CA-C 111.796 -0.522 . . . . 60.12 111.796 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -68.24 111.71 4.71 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.754 0.312 . . . . 72.52 110.923 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -88.47 -29.6 20.02 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.907 -0.405 . . . . 75.04 109.907 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 63.3 mtt -90.27 167.63 12.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.916 -0.583 . . . . 51.44 110.111 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.09 144.01 27.29 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 109.433 -0.58 . . . . 74.21 109.433 176.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.445 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo -59.48 150.34 76.16 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.701 2.267 . . . . 55.24 112.255 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.15 110.104 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.23 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 72.44 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 72.33 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.35 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.24 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.478 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.3 p80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 73.24 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.34 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.14 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.411 ' CG1' HD12 ' A' ' 43' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.1 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.41 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 74.45 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.34 111.165 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.34 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.34 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 72.22 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.54 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.11 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.465 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.03 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 71.53 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.52 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.33 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 72.32 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.14 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.465 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 62.34 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.45 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.31 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.432 HG23 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 74.22 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.13 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.45 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' HG23 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.53 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 63.05 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.03 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.03 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 74.23 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.43 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.489 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 71.54 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.02 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.451 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 74.24 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.45 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.01 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.01 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.55 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.45 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.34 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.43 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.22 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.32 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.33 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.13 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.12 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.41 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.21 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.42 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.44 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 65.05 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.32 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.43 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.04 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.3 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.44 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.02 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.52 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.478 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.53 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.23 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 73.02 110.119 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.24 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.23 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 65.12 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.33 110.638 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.32 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.429 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.14 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.41 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.44 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.24 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.473 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.13 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.31 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 75.22 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.23 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.05 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.59 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.24 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.532 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 75.41 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.42 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.3 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.432 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.43 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.11 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.51 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.44 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.14 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.42 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.44 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.03 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.12 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 73.12 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.11 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.43 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.33 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.42 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.406 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.12 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.44 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.3 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 63.33 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.24 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.22 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.31 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.257 0 N-CA-C 111.833 -0.507 . . . . 51.15 111.833 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -72.79 106.17 4.65 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.741 0.305 . . . . 72.0 110.491 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -78.19 -33.97 49.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.337 -0.392 . . . . 51.22 110.213 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -119.54 143.0 47.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.586 . . . . 72.23 109.75 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -67.19 133.67 93.48 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.099 -0.334 . . . . 73.01 110.099 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -58.22 160.16 16.98 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.664 2.243 . . . . 53.35 111.493 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.24 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.31 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.43 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.53 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 65.24 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.502 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 65.53 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.542 ' ND1' HD13 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.2 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.13 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.552 HD11 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.43 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.54 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.467 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.14 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.02 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.467 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.22 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.43 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.44 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.11 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.12 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.53 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.41 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.33 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.32 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.54 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.42 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.43 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.44 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.14 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.14 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.3 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.03 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.13 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.31 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.33 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.32 111.087 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.33 109.501 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.31 110.928 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.03 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.23 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.449 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.03 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.13 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.54 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.506 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.13 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.11 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.11 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.13 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.506 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 75.32 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.11 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.21 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.14 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.54 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.52 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.24 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.464 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.13 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.3 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 74.24 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.11 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.22 111.995 -176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.03 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.433 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.42 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 74.43 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.03 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.03 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.464 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.41 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.433 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.53 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.502 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 72.4 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.542 HD13 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 54.42 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.472 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.1 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.44 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.41 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.1 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.43 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.478 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.1 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.22 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.44 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.11 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.13 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.02 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.478 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.45 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.41 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.12 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.457 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.55 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.05 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.22 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.3 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.05 110.726 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.11 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.33 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.487 ' SD ' HG23 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.44 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.01 110.544 178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.24 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.12 112.041 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.499 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.44 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.24 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.13 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.11 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.33 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.05 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.51 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 70.34 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.45 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.21 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.13 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.44 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 75.33 110.137 179.286 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.339 0 N-CA-C 111.718 -0.553 . . . . 62.21 111.718 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -79.97 90.08 5.35 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.951 0.405 . . . . 71.45 110.128 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -80.33 -37.29 32.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.208 -0.451 . . . . 71.31 110.575 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtm -79.4 170.6 16.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.365 -0.379 . . . . 72.34 110.235 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.44 ' HG3' ' HB3' ' A' ' 93' ' ' PHE . 3.6 mp0 59.42 85.47 0.18 Allowed Pre-proline 0 C--O 1.236 0.352 0 O-C-N 123.646 0.591 . . . . 75.13 110.42 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -57.52 145.03 90.68 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.816 2.344 . . . . 70.11 112.339 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.22 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 73.43 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.23 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.22 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 74.1 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.24 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.498 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.44 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.15 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.415 ' N ' HD22 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.12 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 72.34 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.14 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.431 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.02 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 74.41 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.52 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.43 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 73.02 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.23 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.52 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.3 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.44 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.22 111.205 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.11 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.24 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.23 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.42 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 73.03 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.23 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 75.42 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.2 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.4 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 70.11 110.268 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.577 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.02 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.54 109.483 176.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.577 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.23 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.53 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.03 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.424 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.43 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.52 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.34 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.14 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.13 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.34 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.3 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.15 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.41 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.1 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.43 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.41 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.499 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.21 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.15 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.21 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.51 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.468 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.14 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.53 111.857 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.424 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 75.34 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.3 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.41 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.42 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.45 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.04 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.468 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.53 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.51 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.4 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.23 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.42 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.54 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.15 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.42 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 71.23 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.24 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.32 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.11 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.12 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.673 -177.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.24 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.14 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.3 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.452 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 75.34 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.12 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.51 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.599 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.12 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.34 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.44 ' HB3' ' HG3' ' A' ' 5' ' ' GLU . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.34 111.247 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 64.03 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.1 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.32 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 65.51 109.302 176.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.11 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.31 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 73.41 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.413 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 61.4 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.11 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.34 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.51 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.03 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.43 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.12 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.13 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.42 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.42 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.498 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.31 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.452 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.11 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.02 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.45 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.11 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.558 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.23 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.33 0 N-CA-C 112.235 -0.346 . . . . 73.34 112.235 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 105.72 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.961 0.41 . . . . 74.55 110.74 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -139.89 137.53 34.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.254 -0.43 . . . . 45.52 110.393 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -145.36 173.8 11.68 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.243 -0.435 . . . . 73.24 110.34 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -71.71 128.2 89.94 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 109.626 -0.509 . . . . 74.1 109.626 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.72 153.19 79.25 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.146 1.897 . . . . 75.33 110.915 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.21 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.4 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.24 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.43 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.22 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.21 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.415 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 74.31 112.881 -175.036 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.44 HD22 HD13 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.54 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.21 111.156 -178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.23 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.12 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 54.51 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.22 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 65.54 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.42 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.35 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.13 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.41 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 75.4 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.33 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.54 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.12 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.22 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.12 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.12 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.11 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.12 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.434 HG23 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 74.14 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.22 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.2 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' HG2' HG23 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.42 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.14 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.15 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.41 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 74.22 111.047 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.4 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.13 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.413 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 74.11 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.23 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.22 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.42 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.34 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 71.11 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.33 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.12 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.44 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.34 111.723 -177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.53 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.14 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.407 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.53 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.42 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.23 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.01 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.13 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.407 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 74.21 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.14 108.264 175.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.11 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.04 112.383 -176.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.21 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 74.01 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.23 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.53 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.01 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.415 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.44 112.636 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 63.53 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.501 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.11 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.31 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 73.32 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 73.41 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.31 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.41 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.451 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.33 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.35 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.23 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.11 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.451 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.32 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.2 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 63.31 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.21 111.401 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.22 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 72.15 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.14 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.24 111.457 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 71.12 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.31 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.43 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 73.01 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.3 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.55 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.44 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.33 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.14 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.14 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.22 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.43 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 75.23 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.31 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.01 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.24 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.44 HD13 HD22 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 73.41 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.409 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.45 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 62.33 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.54 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.03 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.33 110.388 -179.244 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.234 0 N-CA-C 111.387 -0.685 . . . . 74.44 111.387 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 t -80.43 97.34 7.04 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.11 0.481 . . . . 75.12 109.869 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.409 ' HD2' ' OE2' ' A' ' 5' ' ' GLU . 50.7 t60 -137.49 125.59 22.93 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.87 -0.604 . . . . 75.44 109.741 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.479 ' O ' ' HD3' ' A' ' 6' ' ' PRO . 93.5 mmm -85.36 140.1 31.04 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.296 -0.411 . . . . 72.45 110.813 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.409 ' OE2' ' HD2' ' A' ' 3' ' ' HIS . 35.0 mm-40 -100.71 103.25 23.14 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.182 -0.463 . . . . 70.15 110.347 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.479 ' HD3' ' O ' ' A' ' 4' ' ' MET . 8.8 Cg_exo -73.09 135.46 23.02 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.288 1.992 . . . . 65.12 111.292 177.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.13 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.44 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.2 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.51 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.14 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 73.21 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 75.15 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.42 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.42 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 62.4 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.33 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.11 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.12 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.11 110.741 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.22 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 72.22 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.24 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.45 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.41 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.41 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.31 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.557 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.3 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 71.23 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 61.41 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.31 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.41 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.22 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.01 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.41 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.12 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.41 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.41 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 74.52 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.11 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.469 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.23 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.02 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.42 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.15 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.55 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.15 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.35 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.409 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.24 110.111 178.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.31 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.14 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.51 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 46' ' ' TYR . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.3 111.763 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.31 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.1 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.1 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.52 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.41 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 73.13 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.34 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.14 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 54.13 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.54 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.44 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.554 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 61.12 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.01 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 72.22 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 65.23 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.557 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.05 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.45 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.44 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.14 110.749 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 73.14 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.03 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.554 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 75.41 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.23 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.13 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.43 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.461 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.44 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 75.25 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.21 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.42 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.52 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.41 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.43 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.3 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.4 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.31 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.55 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.568 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.31 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 74.33 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.455 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.11 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.41 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.44 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.13 109.797 178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.14 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.43 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.21 110.416 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.02 110.997 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.1 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.12 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.41 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.14 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.45 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 60.43 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.43 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 73.04 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.52 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.44 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 73.01 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.42 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.34 108.843 175.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.2 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 74.04 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 60.21 110.245 -179.097 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 112.292 -0.323 . . . . 43.11 112.292 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 p -145.88 -166.46 2.46 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 109.73 -0.47 . . . . 71.22 109.73 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -89.63 -48.09 7.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.938 0.399 . . . . 62.25 110.569 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.403 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 26.3 ttt -87.03 -24.34 24.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.062 -0.517 . . . . 64.31 110.776 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 12.3 mm-40 72.7 145.75 0.11 Allowed Pre-proline 0 N--CA 1.47 0.548 0 C-N-CA 123.465 0.706 . . . . 73.52 111.945 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 6.0 Cg_exo -74.76 141.69 27.72 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.478 2.119 . . . . 70.23 111.859 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.04 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.02 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.23 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.1 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 74.01 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.43 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.03 112.115 -176.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.54 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.12 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.43 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.57 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.31 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.22 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 64.41 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.3 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 75.45 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.43 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 73.35 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.1 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.4 ' HB2' HD13 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.1 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.12 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.32 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.13 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.4 HD13 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.53 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.05 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.24 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 61.05 110.503 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.42 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.12 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.33 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.533 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.43 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.31 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.2 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.33 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.14 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.44 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.02 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.404 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.31 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.42 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.01 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.31 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 74.32 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.1 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.41 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.21 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.13 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.43 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.14 111.252 -179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 63.22 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.3 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.422 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.44 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.44 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.14 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.22 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.422 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 75.44 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 73.14 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.419 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.12 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 75.32 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.42 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.42 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.4 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.31 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.04 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.31 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.53 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.22 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.22 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 55.13 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.24 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.23 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.44 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.437 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.14 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.01 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.42 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.33 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.41 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 74.44 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.32 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.3 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.21 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . 0.41 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.12 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.52 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.42 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.42 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 74.22 110.423 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 74.44 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.35 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.35 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.44 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.04 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.24 110.585 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.54 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.52 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.55 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.55 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.3 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.42 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.54 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.22 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.31 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.31 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.41 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 41.13 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.089 0 N-CA-C 111.573 -0.611 . . . . 74.3 111.573 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 t -93.24 142.51 27.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 110.246 -0.279 . . . . 73.23 110.246 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -78.39 -40.31 36.49 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.727 -0.472 . . . . 73.2 109.727 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.5 mmm -79.93 133.44 36.2 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 108.712 -0.847 . . . . 71.33 108.712 176.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 56.26 69.13 1.92 Allowed Pre-proline 0 CA--C 1.534 0.336 0 O-C-N 123.665 0.603 . . . . 55.14 109.778 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.15 142.85 93.46 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.863 2.375 . . . . 74.31 112.683 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 74.02 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 75.12 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.01 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.53 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.42 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 70.11 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.45 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.6 OUTLIER -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 71.11 112.066 -177.573 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.11 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.2 110.921 -178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.31 108.689 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.22 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.21 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.51 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.14 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.33 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.31 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.53 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.48 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.55 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.52 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.558 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.04 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.03 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.42 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.31 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.21 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.24 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.54 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.4 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.53 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.2 110.199 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.44 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.42 110.297 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.543 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.54 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.54 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 74.24 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.14 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.543 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.21 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.622 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 74.32 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.53 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 75.1 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.31 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.41 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 54.42 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.54 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.24 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.11 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.01 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.21 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.42 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.02 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.43 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.31 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.12 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 75.54 112.998 -178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.34 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.02 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.43 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.42 111.628 -178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.04 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.15 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.13 111.78 179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.42 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.12 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.12 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.428 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.13 112.978 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.22 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.43 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.05 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.44 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.54 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.34 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.45 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.51 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.14 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.48 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 74.2 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.48 ' H ' ' HG3' ' A' ' 84' ' ' MET . 15.7 mm100 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.51 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.24 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.41 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.21 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.12 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.1 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.1 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.45 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.22 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.52 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.33 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.35 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.43 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.15 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.02 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.44 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.13 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.44 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.31 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.52 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.14 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.24 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.23 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.14 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.15 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 75.52 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.14 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.52 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.02 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.23 110.178 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.237 0.43 0 N-CA-C 112.951 0.327 . . . . 63.34 112.951 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 53.32 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.11 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.24 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.03 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 52.22 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.43 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.485 HD23 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.12 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.21 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HE3' HD11 ' A' ' 15' ' ' LEU . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.13 110.555 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.44 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 32.1 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.15 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.458 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.11 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.47 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.03 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.482 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.04 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.01 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 73.22 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.23 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.34 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.23 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.44 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.52 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.45 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.05 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 64.42 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.23 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.1 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.04 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.23 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.23 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 63.32 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.32 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.03 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.02 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.34 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.14 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 72.13 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.55 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.32 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.4 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.22 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.02 111.606 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.41 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.03 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.43 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.24 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.42 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.13 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.3 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.32 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.02 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.482 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.3 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.11 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.44 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.41 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.4 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 53.21 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.32 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.23 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.42 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.24 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.32 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 61.31 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.01 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.41 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.32 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.44 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.35 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.13 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.33 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.43 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.35 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.1 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.51 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.21 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.46 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.14 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.14 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.41 ' HB2' HG21 ' A' ' 106' ' ' THR . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.54 110.122 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.41 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.23 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.21 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.596 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.4 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.04 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.12 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.13 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.23 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.507 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.52 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.34 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.14 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.507 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.4 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.21 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.54 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.42 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.01 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.35 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.34 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 88' ' ' PHE . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.44 109.754 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.53 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.47 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 51.21 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.14 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 72.32 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 61.03 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.02 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.1 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.3 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 73.42 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.24 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.34 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 C--O 1.231 0.154 0 N-CA-C 111.138 -0.37 . . . . 72.35 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 35.33 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.21 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.11 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.44 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.14 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 52.45 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.12 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.11 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.624 HD13 ' CE1' ' A' ' 111' ' ' HIS . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.43 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.2 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.2 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 53.54 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.33 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.44 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 63.44 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.13 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.46 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.43 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 61.43 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.32 109.292 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 63.35 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.11 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.501 ' HB2' HD13 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.34 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.2 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.12 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.502 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.31 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.14 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 38' ' ' GLU . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.53 111.122 -177.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.04 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.24 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 35' ' ' THR . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.14 109.866 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 53.42 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.11 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 70.04 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 73.12 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.34 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 64.43 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.21 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 54.34 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 43.4 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 71.31 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.13 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.55 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.41 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.21 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.42 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 58' ' ' GLU . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.31 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.43 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.24 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.15 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.15 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.23 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.44 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.41 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 26' ' ' SER . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.42 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.428 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.41 110.591 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.13 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.21 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.45 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.42 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.449 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.33 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.43 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.34 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 61.21 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.32 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.55 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 54.31 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.4 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.44 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.14 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.11 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.04 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.41 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.02 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.617 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 65.12 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.55 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.33 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.43 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.33 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 74.1 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.2 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 71.32 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.32 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.54 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.53 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.44 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.33 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.431 ' HB3' HD11 ' A' ' 95' ' ' LEU . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 55.32 110.555 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.33 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.43 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 72.41 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.24 110.235 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.13 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.35 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.34 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.45 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.624 ' CE1' HD13 ' A' ' 15' ' ' LEU . 31.6 m80 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 73.15 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.11 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.617 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.4 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 100' ' ' MET . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.33 109.328 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 55.32 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 71.53 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HA ' HG23 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.03 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 C--O 1.237 0.446 0 CA-C-O 121.098 0.374 . . . . 72.22 112.865 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.401 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.32 110.893 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 62.12 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.23 110.352 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.11 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.34 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.45 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.54 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.49 HD23 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.45 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 51.45 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.52 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.32 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.43 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.1 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.42 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 50.13 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 71.31 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 71.41 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 52.04 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.23 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.444 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.21 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.43 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.23 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.14 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.22 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.452 HG23 ' HG2' ' A' ' 34' ' ' ARG . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.42 109.251 177.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 43.14 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HG2' HG23 ' A' ' 32' ' ' ILE . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.41 110.282 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.41 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.22 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.54 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.51 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.01 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.42 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.41 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.3 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.12 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.42 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.32 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.4 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.2 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.33 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.3 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.33 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.41 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.24 110.923 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.23 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.43 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.24 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 72.43 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.42 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.14 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.22 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 52.41 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.41 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.2 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.436 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 42.4 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.13 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.43 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.31 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.33 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 62.15 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.34 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.23 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.44 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.51 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.42 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.11 110.61 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.02 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.43 111.175 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.413 ' HG3' ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.44 111.418 178.586 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.52 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.32 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.12 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.04 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.31 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 52.21 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 64.33 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.521 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.3 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.24 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.54 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.635 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.21 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.32 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 64.13 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.45 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.12 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.23 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 117' ' ' GLU . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.04 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.43 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.42 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.42 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.518 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.11 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.04 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.45 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.21 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 63.5 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.41 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.21 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 62.54 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.44 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.52 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 63.23 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.521 HG12 ' CE2' ' A' ' 88' ' ' PHE . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.11 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 51.13 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 71.03 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.53 110.481 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo . . . . . 0 C--O 1.238 0.511 0 CA-C-O 120.927 0.303 . . . . 55.24 112.255 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.15 110.104 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.23 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 55.42 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.519 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 63.41 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.35 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.24 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.421 ' CE1' HD21 ' A' ' 76' ' ' LEU . 7.4 p-80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 71.54 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.34 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.14 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.432 HG12 ' HB ' ' A' ' 110' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.1 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.473 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.41 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 73.24 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 36' ' ' LYS . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.34 111.165 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.53 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.34 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.34 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 63.44 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.54 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.11 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.501 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.03 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 64.41 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.52 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.33 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 44.33 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.14 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.501 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 53.23 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.45 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.0 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 71.25 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.13 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.45 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.53 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 54.02 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.03 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.03 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 73.14 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.43 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 62.41 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.02 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 61.22 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.45 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.01 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.01 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.55 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.45 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.34 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.43 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.22 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.32 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.33 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.13 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.12 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.41 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.21 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.42 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.44 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 52.44 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.32 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.43 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.04 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.3 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.44 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.02 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.52 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 12' ' ' SER . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.53 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.23 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.421 HD21 ' CE1' ' A' ' 13' ' ' HIS . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 64.52 110.119 176.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.24 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.23 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 63.23 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.33 110.638 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.32 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.14 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.41 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.44 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.24 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.13 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.31 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 62.14 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.23 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.05 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.24 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 70.32 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.42 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.3 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.43 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.11 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.51 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.44 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.14 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.42 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.44 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.03 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.12 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 72.2 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.11 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.43 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.33 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.42 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.432 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.12 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.44 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.3 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 41.33 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.481 HH22 ' HG2' ' A' ' 6' ' ' PRO . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.24 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.22 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.31 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo . . . . . 0 C--O 1.236 0.422 0 N-CA-C 111.493 -0.233 . . . . 53.35 111.493 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.24 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.31 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.43 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.53 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 63.23 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 62.51 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.547 ' ND1' HD11 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.12 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.13 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.43 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.54 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.14 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.02 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.22 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.43 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.44 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.11 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.12 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.53 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.41 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.33 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.32 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.54 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.42 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.43 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.44 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.14 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.14 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.3 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.03 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.13 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.31 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.33 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 42' ' ' LEU . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.32 111.087 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 41' ' ' GLU . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.33 109.501 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 103' ' ' PRO . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.31 110.928 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.03 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.23 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.03 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.13 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.54 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.517 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.13 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.11 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.11 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.13 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 72.41 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.11 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.21 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.14 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.54 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.52 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.24 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.471 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.13 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.3 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 64.21 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.11 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.495 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.22 111.995 -176.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.03 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.472 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.42 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 70.51 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.03 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.03 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.41 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.472 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.53 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 64.21 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.547 HD11 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 53.23 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.1 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.44 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.41 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.1 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.43 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.1 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.22 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.44 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.11 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.13 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.02 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.45 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.41 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.618 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.12 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.469 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.55 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.05 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.22 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.3 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 117' ' ' GLU . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.05 110.726 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.11 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.33 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.486 ' SD ' HG21 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.44 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.432 ' HB3' HD11 ' A' ' 95' ' ' LEU . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.01 110.544 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.24 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.453 ' HB3' HG21 ' A' ' 43' ' ' ILE . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.12 112.041 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.511 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.44 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.24 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.13 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.11 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.33 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.05 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.567 ' CE1' HD13 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.51 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 63.1 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.45 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.21 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.13 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.44 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.434 ' HA ' HG23 ' A' ' 97' ' ' THR . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 52.12 110.137 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.469 0.081 0 CA-C-O 120.878 0.282 . . . . 45.52 112.339 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.468 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.22 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 64.14 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.23 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.602 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.22 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 73.53 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.24 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.506 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.44 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.15 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.12 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 53.32 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.14 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.452 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.02 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 43.2 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.52 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.43 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 65.45 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.23 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.52 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.3 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.44 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' O ' ' A' ' 63' ' ' GLN . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.22 111.205 -178.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.11 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.24 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.23 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.42 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 63.34 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.23 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 72.11 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.2 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.4 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 64.32 110.268 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.589 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.02 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.54 109.483 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.23 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.53 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.03 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.43 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.52 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.34 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.14 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.13 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.34 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.3 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.15 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.41 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.1 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.43 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.3 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.51 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.21 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.15 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.21 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.51 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.48 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.14 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.405 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 96.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.53 111.857 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 72.4 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.3 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.41 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.42 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.45 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.04 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.48 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.53 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.51 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.4 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.23 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.42 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.54 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.15 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.42 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.497 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 61.24 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.24 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.32 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.11 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.12 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.413 ' HG3' ' HB3' ' A' ' 88' ' ' PHE . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.673 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.24 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.14 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.3 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.458 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 62.21 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.12 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.51 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.12 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.34 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.34 111.247 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 61.22 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.1 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.32 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.409 HG23 ' HA ' ' A' ' 117' ' ' GLU . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 64.25 109.302 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.11 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.31 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 55.44 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 54.34 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.11 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.34 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.51 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.03 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.43 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.12 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.13 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.42 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.42 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.31 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.458 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.11 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.02 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.45 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.11 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.23 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo . . . . . 0 N--CA 1.46 -0.462 0 N-CA-C 110.915 -0.456 . . . . 75.33 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.21 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.4 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.24 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.43 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.22 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.21 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 73.23 112.881 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 HD12 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.54 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 67' ' ' ALA . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.21 111.156 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.23 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.12 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 32.44 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.22 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 64.3 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.42 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.35 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.13 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.41 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.528 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.33 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.54 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.12 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.22 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.12 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.12 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.11 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.12 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.513 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 55.41 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.22 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.2 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HG2' HG22 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.42 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.14 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.15 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.41 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.518 HG23 HD11 ' A' ' 112' ' ' ILE . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 70.14 111.047 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.4 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.13 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.403 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 50.31 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.23 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.22 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.42 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.34 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 70.41 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.33 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.12 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.44 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.402 ' HD1' HD13 ' A' ' 50' ' ' ILE . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.34 111.723 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.53 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.14 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.416 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.53 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.23 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.01 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.13 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 73.2 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' HD12 ' A' ' 14' ' ' LEU . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.14 108.264 175.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.11 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.04 112.383 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.21 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 65.14 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.23 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.53 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.01 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.44 112.636 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 55.51 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.11 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.31 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 55.44 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 53.42 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.31 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.41 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.47 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.33 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.35 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.23 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.11 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.47 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.32 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.2 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 55.02 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.21 111.401 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.22 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 71.3 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.14 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.24 111.457 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 64.11 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.31 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.43 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 65.01 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.3 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.55 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.44 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.33 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.14 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.14 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.22 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.43 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 74.41 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.31 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.01 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.24 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 51.23 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.408 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.45 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 43.15 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.44 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.03 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.33 110.388 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.462 ' HD2' ' CE2' ' A' ' 93' ' ' PHE . 8.8 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 111.292 -0.311 . . . . 65.12 111.292 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.13 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.44 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.2 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.51 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.14 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 63.04 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 73.03 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.42 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.42 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 61.41 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.33 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.11 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.12 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.11 110.741 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.22 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 71.33 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.24 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.45 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.41 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.41 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.31 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.3 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 64.14 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 50.13 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.31 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.419 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.22 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.01 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.12 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.41 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.41 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 73.22 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.11 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.23 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.02 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.42 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.15 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.55 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.15 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.35 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.24 110.111 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.31 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.14 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.51 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.3 111.763 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.31 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.1 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.1 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.52 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.41 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 64.33 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.34 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.14 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 24.05 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.54 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.44 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.561 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 51.4 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.01 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 61.13 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 61.1 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.563 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.05 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.45 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.44 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.409 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.14 110.749 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 71.34 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.03 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.561 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 72.33 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.23 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.13 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.43 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.44 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 73.42 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.21 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.479 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.42 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.52 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.41 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.35 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.3 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.4 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.479 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.31 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.55 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.31 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 70.34 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.11 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.41 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.44 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.404 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.13 109.797 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.14 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.43 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.21 110.416 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.459 ' HB2' HD13 ' A' ' 114' ' ' LEU . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.02 110.997 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.1 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.12 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.41 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.14 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.45 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 54.22 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.43 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 65.12 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.52 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.44 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 72.43 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.42 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 100' ' ' MET . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.34 108.843 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.2 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 73.03 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 51.43 110.245 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 120.801 0.25 . . . . 70.23 111.859 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.04 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.02 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.23 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.1 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 51.45 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.43 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.03 112.115 -176.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.54 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.12 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.43 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.583 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.31 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.22 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.583 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 63.25 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.3 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 74.32 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.13 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 54.11 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.1 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.423 ' HB2' HD11 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.1 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.12 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.32 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.13 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.423 HD11 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.53 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.05 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.24 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.404 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 54.22 110.503 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.42 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.12 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.33 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.43 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.31 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.2 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.22 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.14 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.44 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.02 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.31 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.42 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.01 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.31 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 73.52 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.1 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.41 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.21 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.13 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.43 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.424 ' O ' HD13 ' A' ' 60' ' ' LEU . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.14 111.252 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 62.44 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.3 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.44 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.44 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.14 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.22 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 65.34 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 64.2 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.12 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 62.24 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.42 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.42 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.4 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.31 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.04 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.31 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.53 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.496 ' O ' HD23 ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.22 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.22 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 53.3 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.24 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.23 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 53.2 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.14 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.01 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.42 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.33 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.433 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 54.5 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.32 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.3 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.21 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.12 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.52 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.42 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.42 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 73.33 110.423 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 73.2 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.35 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.35 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.44 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.04 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.419 ' HB2' HD11 ' A' ' 95' ' ' LEU . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.24 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.54 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.52 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.55 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.55 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.3 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.42 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.54 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.22 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.31 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.31 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 35.3 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 C--O 1.237 0.465 0 CA-C-O 121.166 0.402 . . . . 74.31 112.683 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 51.14 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 74.22 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.01 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.53 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.42 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 53.04 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 5.4 p-80 -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 64.32 112.066 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.11 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 67' ' ' ALA . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.2 110.921 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.409 ' CG1' HD11 ' A' ' 43' ' ' ILE . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.25 108.689 176.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.22 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.21 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.51 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.14 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.33 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.31 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.53 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.55 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.52 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.571 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.04 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.03 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.42 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.31 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.21 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.24 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.54 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.4 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.53 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 38' ' ' GLU . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.2 110.199 178.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.44 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.42 110.297 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.54 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.54 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 72.4 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.14 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.21 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 71.34 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.53 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 73.52 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.31 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.41 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 53.44 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.54 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.24 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.11 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.01 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.21 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.42 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.02 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.43 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.31 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.12 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 70' ' ' ALA . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 71.04 112.998 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.34 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.02 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.571 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.43 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.42 111.628 -178.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.04 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.15 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.405 ' CA ' ' HA ' ' A' ' 62' ' ' SER . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.13 111.78 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.42 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.12 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.12 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.13 112.978 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.22 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.43 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.05 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.44 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.54 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.34 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.45 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.51 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.14 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.485 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 73.01 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.485 ' H ' ' HG3' ' A' ' 84' ' ' MET . 83.2 mm-40 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.51 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.24 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.41 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.21 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.12 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.1 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.1 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.45 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.22 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.52 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.33 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.35 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.43 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.15 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.02 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.44 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.13 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.44 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.31 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.52 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.14 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.24 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.23 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.14 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.15 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 55.02 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.14 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.52 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.02 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.23 110.178 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.156 0 N-CA-C 111.738 -0.545 . . . . 62.21 111.738 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -84.03 -45.91 12.58 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.758 0.313 . . . . 71.25 110.502 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -109.41 151.13 27.07 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.067 -0.253 . . . . 74.52 110.578 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.5 mtm -97.49 -174.65 2.98 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.673 -0.492 . . . . 53.3 109.673 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.15 128.08 93.45 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.513 -0.551 . . . . 70.52 109.513 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.91 118.04 3.53 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.012 2.474 . . . . 63.34 112.951 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 53.32 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.11 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.24 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.03 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 52.22 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.43 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.485 HD23 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.12 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.21 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HE3' HD11 ' A' ' 15' ' ' LEU . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.13 110.555 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.44 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 32.1 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.15 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.458 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.11 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.47 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.03 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.482 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.04 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.01 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 73.22 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.23 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.34 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.23 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.44 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.52 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.45 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.05 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 64.42 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.23 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.1 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.04 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.23 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.23 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 63.32 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.32 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.03 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.02 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.34 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.14 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 72.13 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.55 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.32 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.4 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.22 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.02 111.606 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.41 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.03 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.43 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.24 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.42 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.13 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.3 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.32 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.02 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.482 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.3 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.11 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.44 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.41 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.4 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 53.21 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.32 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.23 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.42 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.24 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.32 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 61.31 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.01 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.41 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.32 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.44 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.35 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.13 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.33 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.43 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.35 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.1 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.51 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.21 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.46 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.14 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.14 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.41 ' HB2' HG21 ' A' ' 106' ' ' THR . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.54 110.122 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.41 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.23 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.21 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.596 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.4 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.04 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.12 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.13 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.23 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.507 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.52 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.34 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.14 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.507 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.4 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.21 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.54 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.42 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.01 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.35 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.34 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 88' ' ' PHE . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.44 109.754 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.53 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.47 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 51.21 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.14 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 72.32 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 61.03 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.02 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.1 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.3 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 73.42 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.24 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.34 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.405 0 N-CA-C 111.707 -0.557 . . . . 73.13 111.707 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 m -99.5 134.16 42.77 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.872 0.367 . . . . 62.35 111.055 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -154.61 132.78 11.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.083 -0.508 . . . . 74.12 110.414 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.454 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 46.1 ttm -113.34 148.32 35.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.141 -0.481 . . . . 70.11 110.246 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 4' ' ' MET . 42.0 tt0 73.46 138.07 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.557 0 O-C-N 123.858 0.724 . . . . 64.21 111.271 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.58 116.81 3.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.519 2.146 . . . . 72.35 111.138 177.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 35.33 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.21 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.11 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.44 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.14 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 52.45 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.12 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.11 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.624 HD13 ' CE1' ' A' ' 111' ' ' HIS . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.43 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.2 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.2 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 53.54 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.33 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.44 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 63.44 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.13 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.46 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.43 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 61.43 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.32 109.292 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 63.35 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.11 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.501 ' HB2' HD13 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.34 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.2 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.12 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.502 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.31 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.14 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 38' ' ' GLU . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.53 111.122 -177.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.04 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.24 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 35' ' ' THR . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.14 109.866 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 53.42 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.11 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 70.04 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 73.12 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.34 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 64.43 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.21 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 54.34 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 43.4 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.35 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 71.31 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.13 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.55 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.41 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.21 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.42 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 58' ' ' GLU . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.31 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.43 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.24 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.15 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.15 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.23 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.44 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.41 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 26' ' ' SER . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.42 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.428 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.41 110.591 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.13 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.21 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.45 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.42 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.449 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.33 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.43 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.34 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 61.21 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.32 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.55 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 54.31 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.4 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.44 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.14 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.11 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.04 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.41 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.02 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.617 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 65.12 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.55 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.33 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.43 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.33 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 74.1 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.2 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 71.32 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.32 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.54 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.53 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.44 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.33 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.431 ' HB3' HD11 ' A' ' 95' ' ' LEU . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 55.32 110.555 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.33 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.43 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 72.41 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.24 110.235 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.13 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.35 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.34 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.45 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.624 ' CE1' HD13 ' A' ' 15' ' ' LEU . 31.6 m80 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 73.15 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.11 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.617 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.4 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 100' ' ' MET . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.33 109.328 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 55.32 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 71.53 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HA ' HG23 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.03 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 112.056 -0.418 . . . . 72.15 112.056 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 m -76.24 141.5 41.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.921 0.391 . . . . 73.54 111.289 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -149.36 22.81 0.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.979 -0.555 . . . . 64.32 110.482 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.3 mtp -132.36 169.33 16.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.926 -0.579 . . . . 72.14 110.553 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -82.07 126.9 73.67 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.438 -0.346 . . . . 71.53 110.303 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.9 161.46 36.41 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.048 2.499 . . . . 72.22 112.865 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.401 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.32 110.893 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 62.12 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.23 110.352 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.11 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.34 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.45 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.54 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.49 HD23 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.45 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 51.45 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.52 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.32 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.43 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.1 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.42 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 50.13 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 71.31 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 71.41 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 52.04 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.23 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.444 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.21 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.43 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.23 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.14 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.22 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.452 HG23 ' HG2' ' A' ' 34' ' ' ARG . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.42 109.251 177.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 43.14 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HG2' HG23 ' A' ' 32' ' ' ILE . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.41 110.282 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.41 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.22 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.54 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.51 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.01 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.42 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.41 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.3 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.12 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.42 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.32 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.4 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.2 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.33 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.3 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.33 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.41 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.24 110.923 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.23 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.43 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.24 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 72.43 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.42 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.14 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.22 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 52.41 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.41 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.2 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.436 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 42.4 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.13 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.43 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.31 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.33 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 62.15 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.34 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.23 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.44 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.51 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.42 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.11 110.61 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.02 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.43 111.175 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.413 ' HG3' ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.44 111.418 178.586 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.52 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.32 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.12 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.04 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.31 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 52.21 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 64.33 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.521 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.3 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.24 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.54 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.635 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.21 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.32 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 64.13 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.45 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.12 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.23 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 117' ' ' GLU . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.04 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.43 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.42 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.42 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.518 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.11 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.04 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.45 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.21 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 63.5 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.41 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.21 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 62.54 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.44 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.52 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 63.23 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.521 HG12 ' CE2' ' A' ' 88' ' ' PHE . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.11 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 51.13 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 71.03 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.53 110.481 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.223 0 N-CA-C 111.796 -0.522 . . . . 60.12 111.796 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -68.24 111.71 4.71 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.754 0.312 . . . . 72.52 110.923 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -88.47 -29.6 20.02 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.907 -0.405 . . . . 75.04 109.907 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 63.3 mtt -90.27 167.63 12.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.916 -0.583 . . . . 51.44 110.111 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.09 144.01 27.29 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 109.433 -0.58 . . . . 74.21 109.433 176.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo -59.48 150.34 76.16 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.701 2.267 . . . . 55.24 112.255 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.15 110.104 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.23 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 55.42 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.519 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 63.41 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.35 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.24 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.421 ' CE1' HD21 ' A' ' 76' ' ' LEU . 7.4 p-80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 71.54 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.34 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.14 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.432 HG12 ' HB ' ' A' ' 110' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.1 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.473 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.41 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 73.24 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 36' ' ' LYS . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.34 111.165 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.53 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.34 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.34 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 63.44 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.54 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.11 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.501 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.03 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 64.41 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.52 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.33 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 44.33 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.14 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.501 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 53.23 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.45 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.0 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 71.25 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.13 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.45 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.53 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 54.02 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.03 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.03 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 73.14 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.43 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 62.41 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.02 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 61.22 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.45 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.01 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.01 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.34 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.55 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.45 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.34 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.43 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.22 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.32 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.33 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.13 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.12 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.41 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.21 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.42 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.44 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 52.44 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.32 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.43 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.04 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.3 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.44 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.02 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.52 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 12' ' ' SER . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.53 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.23 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.421 HD21 ' CE1' ' A' ' 13' ' ' HIS . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 64.52 110.119 176.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.24 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.23 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 63.23 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.33 110.638 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.32 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.14 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.41 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.44 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.24 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.13 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.31 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 62.14 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.23 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.05 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.24 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 70.32 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.42 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.3 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.43 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.11 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.51 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.44 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.14 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.42 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.44 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.03 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.12 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 72.2 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.11 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.43 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.33 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.42 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.432 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.12 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.44 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.3 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 41.33 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.481 HH22 ' HG2' ' A' ' 6' ' ' PRO . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.24 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.22 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.31 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.257 0 N-CA-C 111.833 -0.507 . . . . 51.15 111.833 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -72.79 106.17 4.65 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.741 0.305 . . . . 41.43 110.491 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -78.19 -33.97 49.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.337 -0.392 . . . . 51.22 110.213 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -119.54 143.0 47.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.586 . . . . 72.23 109.75 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -67.19 133.67 93.48 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.099 -0.334 . . . . 73.01 110.099 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -58.22 160.16 16.98 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.664 2.243 . . . . 53.35 111.493 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.24 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.31 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.43 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.53 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 63.23 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 62.51 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.547 ' ND1' HD11 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.12 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.13 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.43 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.54 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.14 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.02 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.22 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.43 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.44 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.11 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.12 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.53 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.41 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.33 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.32 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.54 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.42 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.43 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.44 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.14 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.14 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.3 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.03 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.13 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.31 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.33 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 42' ' ' LEU . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.32 111.087 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 41' ' ' GLU . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.33 109.501 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 103' ' ' PRO . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.31 110.928 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.03 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.23 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.44 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.03 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.13 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.54 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.517 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.13 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.11 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.11 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.13 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 72.41 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.11 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.21 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.14 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.54 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.52 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.24 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.471 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.13 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.3 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 64.21 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.11 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.495 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.22 111.995 -176.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.03 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.472 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.42 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 70.51 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.03 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.03 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.41 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.472 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.53 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 64.21 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.547 HD11 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 53.23 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.1 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.44 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.41 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.1 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.43 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.1 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.22 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.44 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.11 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.13 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.02 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.45 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.41 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.618 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.12 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.469 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.55 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.05 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.22 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.3 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 117' ' ' GLU . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.05 110.726 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.11 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.33 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.486 ' SD ' HG21 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.44 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.432 ' HB3' HD11 ' A' ' 95' ' ' LEU . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.01 110.544 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.24 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.453 ' HB3' HG21 ' A' ' 43' ' ' ILE . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.12 112.041 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.511 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.44 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.24 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.13 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.11 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.33 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.05 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.567 ' CE1' HD13 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.51 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 63.1 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.45 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.21 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.13 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.44 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.434 ' HA ' HG23 ' A' ' 97' ' ' THR . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 52.12 110.137 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.339 0 N-CA-C 111.718 -0.553 . . . . 62.21 111.718 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -79.97 90.08 5.35 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.951 0.405 . . . . 71.45 110.128 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -80.33 -37.29 32.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.208 -0.451 . . . . 54.41 110.575 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtm -79.4 170.6 16.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.365 -0.379 . . . . 72.34 110.235 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HG3' ' HB3' ' A' ' 93' ' ' PHE . 3.6 mp0 59.42 85.47 0.18 Allowed Pre-proline 0 C--O 1.236 0.352 0 O-C-N 123.646 0.591 . . . . 75.13 110.42 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -57.52 145.03 90.68 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.816 2.344 . . . . 45.52 112.339 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.468 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.22 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 64.14 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.23 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.602 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.22 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 73.53 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.24 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.506 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.44 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.15 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.12 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 53.32 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.14 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.452 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.02 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 43.2 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.52 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.43 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 65.45 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.23 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.52 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.3 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.44 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' O ' ' A' ' 63' ' ' GLN . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.22 111.205 -178.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.11 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.24 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.23 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.42 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 63.34 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.23 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 72.11 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.2 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.4 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 64.32 110.268 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.589 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.12 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.02 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.54 109.483 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.23 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.53 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.03 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.436 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.43 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.52 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.34 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.14 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.13 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.34 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.3 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.15 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.41 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.1 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.43 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.3 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.51 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.21 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.15 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.21 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.51 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.48 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.14 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.405 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 96.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.53 111.857 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 72.4 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.3 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.41 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.42 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.45 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.04 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.48 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.53 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.51 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.4 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.23 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.42 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.54 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.15 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.42 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.497 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 61.24 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.24 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.32 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.11 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.12 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.413 ' HG3' ' HB3' ' A' ' 88' ' ' PHE . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.673 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.24 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.14 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.3 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.458 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 62.21 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.12 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.51 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.12 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.34 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.466 ' HB3' ' HG3' ' A' ' 5' ' ' GLU . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.34 111.247 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 61.22 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.1 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.32 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.409 HG23 ' HA ' ' A' ' 117' ' ' GLU . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 64.25 109.302 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.11 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.31 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 55.44 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 54.34 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.11 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.34 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.51 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.03 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.43 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.12 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.13 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.42 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.42 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.31 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.458 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.11 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.02 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.45 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.11 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.23 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.33 0 N-CA-C 112.235 -0.346 . . . . 73.34 112.235 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 105.72 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.961 0.41 . . . . 74.55 110.74 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -139.89 137.53 34.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.254 -0.43 . . . . 45.52 110.393 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -145.36 173.8 11.68 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.243 -0.435 . . . . 73.24 110.34 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -71.71 128.2 89.94 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 109.626 -0.509 . . . . 74.1 109.626 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.72 153.19 79.25 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.146 1.897 . . . . 75.33 110.915 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.21 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.4 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.24 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.43 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.22 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.21 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 73.23 112.881 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 HD12 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.54 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 67' ' ' ALA . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.21 111.156 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.23 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.12 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 32.44 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.22 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 64.3 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.42 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.35 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.13 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.41 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.528 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.33 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.54 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.12 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.22 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.12 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.12 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.11 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.12 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.513 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 55.41 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.22 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.2 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HG2' HG22 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.42 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.14 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.15 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.41 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.518 HG23 HD11 ' A' ' 112' ' ' ILE . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 70.14 111.047 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.4 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.13 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.403 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 50.31 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.23 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.22 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.42 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.34 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 70.41 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.33 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.12 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.44 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.402 ' HD1' HD13 ' A' ' 50' ' ' ILE . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.34 111.723 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.53 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.14 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.416 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.53 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.23 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.01 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.13 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 73.2 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' HD12 ' A' ' 14' ' ' LEU . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.14 108.264 175.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.11 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.04 112.383 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.21 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 65.14 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.23 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.53 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.31 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.01 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.44 112.636 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 55.51 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.11 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.31 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.44 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 55.44 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 53.42 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.31 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.41 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.47 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.33 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.35 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.23 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.11 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.47 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.32 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.2 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 55.02 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.21 111.401 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.22 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 71.3 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.14 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.24 111.457 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 64.11 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.31 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.43 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 65.01 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.3 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.55 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.44 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.33 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.14 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.14 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.22 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.43 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 74.41 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.31 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.01 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.24 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 51.23 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.408 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.45 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 43.15 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.44 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.03 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.33 110.388 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.234 0 N-CA-C 111.387 -0.685 . . . . 74.44 111.387 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 t -80.43 97.34 7.04 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.11 0.481 . . . . 61.4 109.869 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -137.49 125.59 22.93 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.87 -0.604 . . . . 75.44 109.741 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.491 ' O ' ' HD3' ' A' ' 6' ' ' PRO . 93.5 mmm -85.36 140.1 31.04 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.296 -0.411 . . . . 72.45 110.813 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -100.71 103.25 23.14 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.182 -0.463 . . . . 70.15 110.347 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.491 ' HD3' ' O ' ' A' ' 4' ' ' MET . 8.8 Cg_exo -73.09 135.46 23.02 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.288 1.992 . . . . 65.12 111.292 177.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.13 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.44 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.2 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.51 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.14 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 63.04 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 73.03 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.42 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.42 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 61.41 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.33 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.11 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.12 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.11 110.741 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.22 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 71.33 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.24 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.45 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.41 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.41 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.31 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.3 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 64.14 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 50.13 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.31 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.419 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.22 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.01 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.12 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.41 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.41 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 73.22 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.11 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.23 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.02 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.42 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.15 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.55 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.15 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.35 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.24 110.111 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.31 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 73.7 mm-40 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.14 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.51 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.3 111.763 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.31 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.1 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.1 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.52 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.41 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 64.33 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.34 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.14 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 24.05 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.54 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.44 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.561 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 51.4 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.01 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 61.13 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 61.1 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.563 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.05 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.45 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.44 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.409 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.14 110.749 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 71.34 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.03 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.561 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 72.33 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.23 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.13 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.43 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.44 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 73.42 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.21 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.42 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.52 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.01 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.41 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.35 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.3 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.4 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.479 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.31 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.55 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.31 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 70.34 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.11 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.41 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.44 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.404 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.13 109.797 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.14 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.43 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.21 110.416 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.459 ' HB2' HD13 ' A' ' 114' ' ' LEU . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.02 110.997 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.1 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.12 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.41 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.14 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.45 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 54.22 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.43 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 65.12 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.52 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.44 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 72.43 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.42 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 100' ' ' MET . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.34 108.843 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.2 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 73.03 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 51.43 110.245 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 112.292 -0.323 . . . . 43.11 112.292 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 p -145.88 -166.46 2.46 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 109.73 -0.47 . . . . 71.22 109.73 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -89.63 -48.09 7.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.938 0.399 . . . . 62.25 110.569 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 26.3 ttt -87.03 -24.34 24.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.062 -0.517 . . . . 64.31 110.776 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 12.3 mm-40 72.7 145.75 0.11 Allowed Pre-proline 0 N--CA 1.47 0.548 0 C-N-CA 123.465 0.706 . . . . 73.52 111.945 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 6.0 Cg_exo -74.76 141.69 27.72 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.478 2.119 . . . . 70.23 111.859 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.04 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.02 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.23 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.1 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 51.45 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.43 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.03 112.115 -176.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.54 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.12 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.43 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.583 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.31 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.22 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.583 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 63.25 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.3 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 74.32 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.13 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 54.11 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.1 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.423 ' HB2' HD11 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.1 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.12 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.32 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.24 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.13 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.423 HD11 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.53 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.05 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.24 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.404 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 54.22 110.503 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.42 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.12 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.33 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.43 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.31 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.2 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.22 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.14 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.44 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.02 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.31 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.42 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.01 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.31 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 73.52 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.1 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.41 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.21 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.13 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.43 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.424 ' O ' HD13 ' A' ' 60' ' ' LEU . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.14 111.252 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 62.44 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.3 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.44 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.44 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.14 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.22 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 65.34 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 64.2 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.12 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 62.24 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.42 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.42 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.4 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.31 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.04 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.31 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.53 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.496 ' O ' HD23 ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.22 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.22 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 53.3 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.24 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.23 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 53.2 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.14 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.01 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.42 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.33 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.433 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 54.5 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.32 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.3 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.21 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.12 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.52 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.42 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.42 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 73.33 110.423 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 73.2 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.35 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.35 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.44 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.04 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.419 ' HB2' HD11 ' A' ' 95' ' ' LEU . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.24 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.54 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.52 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.55 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.55 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.3 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.42 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.54 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.22 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.31 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.31 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 35.3 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.089 0 N-CA-C 111.573 -0.611 . . . . 74.3 111.573 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 t -93.24 142.51 27.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 110.246 -0.279 . . . . 73.23 110.246 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -78.39 -40.31 36.49 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.727 -0.472 . . . . 73.2 109.727 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.5 mmm -79.93 133.44 36.2 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 108.712 -0.847 . . . . 71.33 108.712 176.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 56.26 69.13 1.92 Allowed Pre-proline 0 CA--C 1.534 0.336 0 O-C-N 123.665 0.603 . . . . 55.14 109.778 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.15 142.85 93.46 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.863 2.375 . . . . 74.31 112.683 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 51.14 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 74.22 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.01 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.53 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.42 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 53.04 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 5.4 p-80 -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 64.32 112.066 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.11 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 67' ' ' ALA . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.2 110.921 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.409 ' CG1' HD11 ' A' ' 43' ' ' ILE . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.25 108.689 176.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.22 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.21 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.51 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.14 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.33 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.31 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.53 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.55 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.52 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.571 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.04 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.03 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.42 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.31 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.21 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.24 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.54 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.4 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.53 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 38' ' ' GLU . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.2 110.199 178.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.44 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.42 110.297 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.54 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.54 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 72.4 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.14 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.21 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 71.34 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.53 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 73.52 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.31 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.41 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 53.44 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.54 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.24 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.11 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.01 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.21 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.42 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.02 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.43 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.31 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.12 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 70' ' ' ALA . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 71.04 112.998 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.34 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.02 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.571 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.43 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.42 111.628 -178.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.04 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.15 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.405 ' CA ' ' HA ' ' A' ' 62' ' ' SER . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.13 111.78 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.42 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.12 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.12 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.13 112.978 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.22 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.43 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.05 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.44 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.54 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.34 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.45 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.51 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.14 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.485 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 73.01 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.485 ' H ' ' HG3' ' A' ' 84' ' ' MET . 83.2 mm-40 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.51 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.24 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.41 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.21 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.32 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.12 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.1 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.1 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.45 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.22 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.52 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.33 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.35 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.43 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.15 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.02 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.44 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.13 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.44 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.31 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.52 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.14 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.24 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.23 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.14 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.15 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 55.02 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.14 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.52 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.02 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.23 110.178 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo . . . . . 0 C--O 1.237 0.43 0 N-CA-C 112.951 0.327 . . . . 63.340000000000003 112.951 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 53.32 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.109999999999999 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.240000000000002 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.030000000000001 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 52.219999999999999 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.430000000000007 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.485 HD23 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.120000000000005 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.209999999999994 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HE3' HD11 ' A' ' 15' ' ' LEU . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.129999999999995 110.555 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.439999999999998 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 32.100000000000001 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.423 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.149999999999999 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.458 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.109999999999999 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.47 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.030000000000001 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.482 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.040000000000006 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.010000000000005 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 73.219999999999999 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.230000000000004 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.340000000000003 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.229999999999997 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.439999999999998 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.519999999999996 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.450000000000003 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.049999999999997 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 64.420000000000002 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.230000000000004 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.099999999999994 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.040000000000006 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.230000000000004 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.452 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.230000000000004 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 63.32 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.319999999999993 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.030000000000001 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.019999999999996 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.340000000000003 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.140000000000001 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 72.129999999999995 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.549999999999997 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.319999999999993 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.400000000000006 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.219999999999999 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.019999999999996 111.606 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.409999999999997 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.030000000000001 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.430000000000007 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.239999999999995 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.420000000000002 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.129999999999995 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.299999999999997 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.319999999999993 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.020000000000003 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.482 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.299999999999997 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.109999999999999 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.439999999999998 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.409999999999997 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.140000000000001 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.400000000000006 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 53.210000000000001 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.319999999999993 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.229999999999997 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.420000000000002 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.239999999999995 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.319999999999993 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 61.310000000000002 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.010000000000005 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.409999999999997 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.319999999999993 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.439999999999998 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.349999999999994 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.129999999999995 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.329999999999998 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.430000000000007 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.350000000000001 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.099999999999994 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.509999999999998 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.210000000000001 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.46 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.140000000000001 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.140000000000001 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.41 ' HB2' HG21 ' A' ' 106' ' ' THR . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.540000000000006 110.122 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.41 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.230000000000004 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.209999999999994 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.596 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.400000000000006 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.040000000000006 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.120000000000005 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.129999999999995 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.230000000000004 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.507 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.519999999999996 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.340000000000003 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.140000000000001 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.507 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.400000000000006 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.209999999999994 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.539999999999999 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.420000000000002 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.010000000000005 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.349999999999994 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.340000000000003 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 88' ' ' PHE . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.439999999999998 109.754 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.530000000000001 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.47 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 51.210000000000001 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.140000000000001 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 72.319999999999993 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 61.030000000000001 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.019999999999996 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.100000000000001 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.299999999999997 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 73.420000000000002 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.239999999999995 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.340000000000003 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 C--O 1.231 0.154 0 N-CA-C 111.138 -0.37 . . . . 72.349999999999994 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 35.329999999999998 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.209999999999994 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.109999999999999 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.439999999999998 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.140000000000001 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 52.450000000000003 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.120000000000005 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.109999999999999 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.428 HD23 ' HB2' ' A' ' 67' ' ' ALA . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.430000000000007 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.200000000000003 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.200000000000003 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 53.539999999999999 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.329999999999998 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.439999999999998 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 63.439999999999998 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.129999999999995 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.46 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.430000000000007 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 61.43 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.319999999999993 109.292 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 63.350000000000001 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.109999999999999 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.501 ' HB2' HD13 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.340000000000003 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.200000000000003 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.119999999999997 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.502 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.310000000000002 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.140000000000001 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 38' ' ' GLU . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.530000000000001 111.122 -177.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.040000000000006 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.239999999999995 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 35' ' ' THR . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.140000000000001 109.866 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 53.420000000000002 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.109999999999999 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 70.040000000000006 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 73.120000000000005 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.340000000000003 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 64.430000000000007 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.209999999999994 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 54.340000000000003 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 43.399999999999999 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.349999999999994 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.120000000000005 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 71.310000000000002 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.130000000000003 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.549999999999997 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.409999999999997 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.209999999999994 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.420000000000002 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 58' ' ' GLU . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.310000000000002 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.430000000000007 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.239999999999995 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.150000000000006 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.149999999999999 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.229999999999997 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.439999999999998 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.409999999999997 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 26' ' ' SER . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.420000000000002 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.428 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.409999999999997 110.591 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.130000000000003 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.210000000000001 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.450000000000003 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.420000000000002 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.449 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.329999999999998 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.430000000000007 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.340000000000003 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 61.210000000000001 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.319999999999993 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.549999999999997 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 54.310000000000002 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.400000000000006 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.439999999999998 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.140000000000001 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.109999999999999 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.040000000000006 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.409999999999997 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.019999999999996 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.617 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 65.120000000000005 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.549999999999997 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.329999999999998 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.430000000000007 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.329999999999998 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 74.099999999999994 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.200000000000003 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 71.319999999999993 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.540000000000006 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.530000000000001 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.439999999999998 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.329999999999998 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.431 ' HB3' HD11 ' A' ' 95' ' ' LEU . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 55.32 110.555 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.329999999999998 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.430000000000007 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 72.409999999999997 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 111' ' ' HIS . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.239999999999995 110.235 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.129999999999995 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.349999999999994 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.340000000000003 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.450000000000003 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.617 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 53.3 m-70 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 73.150000000000006 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.109999999999999 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.617 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.400000000000006 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 100' ' ' MET . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.329999999999998 109.328 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 55.32 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 71.530000000000001 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HA ' HG23 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.030000000000001 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo . . . . . 0 C--O 1.237 0.446 0 CA-C-O 121.098 0.374 . . . . 72.219999999999999 112.865 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.401 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.319999999999993 110.893 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 62.119999999999997 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.230000000000004 110.352 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.109999999999999 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.340000000000003 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.450000000000003 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.540000000000006 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.49 HD23 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.450000000000003 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 51.450000000000003 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.519999999999996 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.319999999999993 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.430000000000007 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.099999999999994 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.420000000000002 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 50.130000000000003 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 71.310000000000002 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 71.409999999999997 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 52.039999999999999 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.230000000000004 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.444 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.209999999999994 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.430000000000007 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.229999999999997 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.140000000000001 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.219999999999999 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.452 HG23 ' HG2' ' A' ' 34' ' ' ARG . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.420000000000002 109.251 177.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 43.140000000000001 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HG2' HG23 ' A' ' 32' ' ' ILE . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.409999999999997 110.282 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.409999999999997 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.219999999999999 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.540000000000006 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.510000000000005 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.010000000000005 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.420000000000002 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.409999999999997 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.299999999999997 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.120000000000005 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.420000000000002 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.319999999999993 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.400000000000006 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.200000000000003 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.329999999999998 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.299999999999997 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.329999999999998 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.409999999999997 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.239999999999995 110.923 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.230000000000004 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.430000000000007 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.239999999999995 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 72.430000000000007 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.140000000000001 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.219999999999999 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 52.409999999999997 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.409999999999997 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.436 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 42.399999999999999 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.129999999999995 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.430000000000007 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.310000000000002 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.329999999999998 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 62.149999999999999 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.340000000000003 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.230000000000004 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.439999999999998 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.509999999999998 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.420000000000002 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.109999999999999 110.61 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.019999999999996 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.430000000000007 111.175 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.413 ' HG3' ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.439999999999998 111.418 178.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.52 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.319999999999993 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.120000000000005 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.040000000000006 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.310000000000002 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 52.210000000000001 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 64.329999999999998 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.521 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.299999999999997 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.240000000000002 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.540000000000006 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.635 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.209999999999994 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.319999999999993 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 64.129999999999995 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.450000000000003 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.119999999999997 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.229999999999997 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 117' ' ' GLU . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.040000000000006 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.430000000000007 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.420000000000002 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.420000000000002 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.518 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.109999999999999 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.040000000000006 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.450000000000003 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.209999999999994 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 63.5 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.409999999999997 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.210000000000001 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 62.539999999999999 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.439999999999998 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.519999999999996 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 63.229999999999997 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.521 HG12 ' CE2' ' A' ' 88' ' ' PHE . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.109999999999999 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 51.130000000000003 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 71.030000000000001 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.530000000000001 110.481 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo . . . . . 0 C--O 1.238 0.511 0 CA-C-O 120.927 0.303 . . . . 55.240000000000002 112.255 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.150000000000006 110.104 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.230000000000004 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 55.420000000000002 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.519 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 63.409999999999997 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.349999999999994 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.239999999999995 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.478 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.3 p80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 71.540000000000006 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.340000000000003 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.140000000000001 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.432 HG12 ' HB ' ' A' ' 110' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.099999999999994 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.473 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.409999999999997 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 73.239999999999995 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 36' ' ' LYS . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.340000000000003 111.165 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.53 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.340000000000003 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.340000000000003 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 63.439999999999998 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.540000000000006 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.109999999999999 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.501 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.030000000000001 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 64.409999999999997 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.519999999999996 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.329999999999998 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 44.329999999999998 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.140000000000001 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.501 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 53.229999999999997 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.450000000000003 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.0 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 71.25 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.130000000000003 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.450000000000003 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.530000000000001 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 54.020000000000003 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.030000000000001 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.030000000000001 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 73.140000000000001 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.430000000000007 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 62.409999999999997 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.020000000000003 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 61.219999999999999 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.450000000000003 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.010000000000005 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.010000000000005 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.340000000000003 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.549999999999997 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.450000000000003 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.340000000000003 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.430000000000007 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.219999999999999 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.319999999999993 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.329999999999998 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.129999999999995 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.120000000000005 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.409999999999997 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.209999999999994 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.420000000000002 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.439999999999998 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 52.439999999999998 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.319999999999993 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.430000000000007 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.040000000000006 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.299999999999997 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.439999999999998 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.019999999999996 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.519999999999996 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.478 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.530000000000001 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.230000000000004 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 64.519999999999996 110.119 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.239999999999995 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.230000000000004 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 63.229999999999997 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.329999999999998 110.638 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.319999999999993 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.140000000000001 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.409999999999997 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.439999999999998 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.239999999999995 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.129999999999995 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.310000000000002 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 62.140000000000001 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.229999999999997 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.049999999999997 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.240000000000002 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 70.319999999999993 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.420000000000002 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.299999999999997 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.430000000000007 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.109999999999999 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.510000000000005 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.439999999999998 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.420000000000002 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.439999999999998 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.030000000000001 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.120000000000005 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 72.200000000000003 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.109999999999999 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.430000000000007 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.329999999999998 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.420000000000002 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.432 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.120000000000005 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.439999999999998 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.299999999999997 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 41.329999999999998 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.481 HH22 ' HG2' ' A' ' 6' ' ' PRO . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.239999999999995 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.219999999999999 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.310000000000002 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo . . . . . 0 C--O 1.236 0.422 0 N-CA-C 111.493 -0.233 . . . . 53.350000000000001 111.493 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.310000000000002 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.430000000000007 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.530000000000001 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 63.229999999999997 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 62.509999999999998 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.547 ' ND1' HD11 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.120000000000005 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.130000000000003 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.430000000000007 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.540000000000006 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.140000000000001 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.019999999999996 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.219999999999999 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.430000000000007 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.439999999999998 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.109999999999999 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.120000000000005 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.530000000000001 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.409999999999997 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.329999999999998 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.319999999999993 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.540000000000006 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.420000000000002 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.430000000000007 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.439999999999998 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.140000000000001 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.140000000000001 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.299999999999997 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.030000000000001 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.129999999999995 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.310000000000002 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.329999999999998 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 42' ' ' LEU . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.319999999999993 111.087 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 41' ' ' GLU . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.329999999999998 109.501 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 103' ' ' PRO . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.310000000000002 110.928 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.030000000000001 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.230000000000004 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.44 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.030000000000001 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.340000000000003 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.129999999999995 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.540000000000006 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.517 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.129999999999995 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.109999999999999 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.109999999999999 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.130000000000003 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 72.409999999999997 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.109999999999999 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.209999999999994 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.140000000000001 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.540000000000006 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.519999999999996 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.240000000000002 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.471 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.129999999999995 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.299999999999997 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 64.209999999999994 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.109999999999999 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.495 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.219999999999999 111.995 -176.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.030000000000001 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.472 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.420000000000002 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 70.510000000000005 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.030000000000001 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.030000000000001 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.409999999999997 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.472 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.530000000000001 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 64.209999999999994 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.547 HD11 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 53.229999999999997 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.099999999999994 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.439999999999998 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.409999999999997 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.099999999999994 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.430000000000007 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.099999999999994 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.219999999999999 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.439999999999998 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.109999999999999 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.129999999999995 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.019999999999996 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.450000000000003 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.409999999999997 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.618 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.120000000000005 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.469 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.549999999999997 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.049999999999997 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.219999999999999 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.299999999999997 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 117' ' ' GLU . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.049999999999997 110.726 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.109999999999999 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.329999999999998 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.486 ' SD ' HG21 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.439999999999998 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.432 ' HB3' HD11 ' A' ' 95' ' ' LEU . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.010000000000005 110.544 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.239999999999995 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.453 ' HB3' HG21 ' A' ' 43' ' ' ILE . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.119999999999997 112.041 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.511 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.439999999999998 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.239999999999995 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.129999999999995 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.109999999999999 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.329999999999998 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.049999999999997 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.567 ' CE1' HD13 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.510000000000005 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 63.100000000000001 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.450000000000003 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.209999999999994 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.129999999999995 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.439999999999998 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.434 ' HA ' HG23 ' A' ' 97' ' ' THR . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 52.119999999999997 110.137 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.469 0.081 0 CA-C-O 120.878 0.282 . . . . 45.520000000000003 112.339 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.468 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.219999999999999 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 64.140000000000001 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.602 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.219999999999999 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 73.530000000000001 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.240000000000002 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.506 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.439999999999998 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.150000000000006 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.119999999999997 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 53.32 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.140000000000001 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.452 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.019999999999996 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 43.200000000000003 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.520000000000003 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.430000000000007 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 65.450000000000003 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.230000000000004 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.520000000000003 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.299999999999997 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.439999999999998 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' O ' ' A' ' 63' ' ' GLN . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.219999999999999 111.205 -178.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.109999999999999 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.239999999999995 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.230000000000004 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.420000000000002 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 63.340000000000003 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.230000000000004 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 72.109999999999999 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.200000000000003 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.400000000000006 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 64.319999999999993 110.268 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.589 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.120000000000005 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.019999999999996 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.539999999999999 109.483 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.230000000000004 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.530000000000001 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.030000000000001 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.436 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.430000000000007 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.520000000000003 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.340000000000003 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.140000000000001 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.129999999999995 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.340000000000003 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.299999999999997 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.150000000000006 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.409999999999997 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.099999999999994 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.430000000000007 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.299999999999997 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.51 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.209999999999994 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.150000000000006 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.209999999999994 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.509999999999998 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.48 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.140000000000001 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.405 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 25.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.530000000000001 111.857 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 72.400000000000006 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.299999999999997 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.420000000000002 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.450000000000003 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.040000000000006 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.48 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.530000000000001 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.510000000000005 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.399999999999999 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.229999999999997 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.420000000000002 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.540000000000006 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.149999999999999 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.420000000000002 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.497 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 61.240000000000002 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.239999999999995 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.319999999999993 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.109999999999999 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.119999999999997 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.413 ' HG3' ' HB3' ' A' ' 88' ' ' PHE . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.409999999999997 110.673 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.239999999999995 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.140000000000001 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.299999999999997 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.458 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 62.210000000000001 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.120000000000005 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.510000000000005 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.120000000000005 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.340000000000003 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.340000000000003 111.247 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 61.219999999999999 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.099999999999994 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.319999999999993 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.409 HG23 ' HA ' ' A' ' 117' ' ' GLU . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 64.25 109.302 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.109999999999999 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.310000000000002 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 55.439999999999998 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 54.340000000000003 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.109999999999999 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.340000000000003 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.510000000000005 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.030000000000001 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.430000000000007 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.120000000000005 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.130000000000003 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.420000000000002 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.420000000000002 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.310000000000002 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.458 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.109999999999999 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.019999999999996 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.450000000000003 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.109999999999999 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.230000000000004 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo . . . . . 0 N--CA 1.46 -0.462 0 N-CA-C 110.915 -0.456 . . . . 75.329999999999998 110.915 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.209999999999994 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.400000000000006 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.430000000000007 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.219999999999999 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.209999999999994 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.415 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 73.230000000000004 112.881 -175.036 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 HD12 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.540000000000006 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 67' ' ' ALA . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.209999999999994 111.156 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.230000000000004 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.120000000000005 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 32.439999999999998 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.219999999999999 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 64.299999999999997 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.420000000000002 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.349999999999994 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.129999999999995 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.409999999999997 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.528 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.329999999999998 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.540000000000006 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.120000000000005 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.219999999999999 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.120000000000005 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.120000000000005 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.109999999999999 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.119999999999997 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.513 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 55.409999999999997 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.219999999999999 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.200000000000003 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HG2' HG22 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.340000000000003 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.420000000000002 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.140000000000001 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.150000000000006 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.409999999999997 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.518 HG23 HD11 ' A' ' 112' ' ' ILE . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 70.140000000000001 111.047 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.400000000000006 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.129999999999995 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.403 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 50.310000000000002 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.230000000000004 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.219999999999999 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.420000000000002 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.340000000000003 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.040000000000006 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 70.409999999999997 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.329999999999998 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.120000000000005 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.439999999999998 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.439999999999998 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.402 ' HD1' HD13 ' A' ' 50' ' ' ILE . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.340000000000003 111.723 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.530000000000001 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.140000000000001 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.416 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.530000000000001 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.230000000000004 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.010000000000005 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.129999999999995 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 73.200000000000003 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' HD12 ' A' ' 14' ' ' LEU . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.140000000000001 108.264 175.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.109999999999999 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.040000000000006 112.383 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.209999999999994 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 65.140000000000001 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.230000000000004 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.530000000000001 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.010000000000005 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.415 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.439999999999998 112.636 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 55.509999999999998 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.109999999999999 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.310000000000002 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 55.439999999999998 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 53.420000000000002 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.310000000000002 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.409999999999997 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.47 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.329999999999998 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.349999999999994 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.230000000000004 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.109999999999999 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.47 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.319999999999993 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.200000000000003 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 55.020000000000003 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.210000000000001 111.401 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.219999999999999 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 71.299999999999997 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.140000000000001 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.240000000000002 111.457 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 64.109999999999999 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.310000000000002 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.430000000000007 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 65.010000000000005 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.299999999999997 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.549999999999997 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.439999999999998 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.329999999999998 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.140000000000001 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.140000000000001 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.219999999999999 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.430000000000007 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 74.409999999999997 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.310000000000002 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.010000000000005 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.239999999999995 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 51.229999999999997 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.408 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.450000000000003 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 43.149999999999999 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.439999999999998 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.030000000000001 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.329999999999998 110.388 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.462 ' HD2' ' CE2' ' A' ' 93' ' ' PHE . 8.8 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 111.292 -0.311 . . . . 65.120000000000005 111.292 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.130000000000003 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.439999999999998 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.200000000000003 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.510000000000005 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.140000000000001 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 63.039999999999999 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 73.030000000000001 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.420000000000002 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.420000000000002 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 61.409999999999997 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.329999999999998 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.109999999999999 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.120000000000005 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.413 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.109999999999999 110.741 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.219999999999999 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 71.329999999999998 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.239999999999995 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.450000000000003 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.409999999999997 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.409999999999997 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.310000000000002 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.299999999999997 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 64.140000000000001 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 50.130000000000003 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.310000000000002 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.419 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.219999999999999 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.010000000000005 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.120000000000005 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.409999999999997 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.409999999999997 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 73.219999999999999 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.109999999999999 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.229999999999997 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.019999999999996 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.420000000000002 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.150000000000006 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.549999999999997 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.150000000000006 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.349999999999994 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.239999999999995 110.111 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.140000000000001 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.510000000000005 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.299999999999997 111.763 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.310000000000002 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.100000000000001 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.099999999999994 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.519999999999996 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.409999999999997 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 64.329999999999998 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.340000000000003 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.140000000000001 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 24.050000000000001 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.540000000000006 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.439999999999998 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.561 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 51.399999999999999 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.010000000000005 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 61.130000000000003 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 61.100000000000001 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.563 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.049999999999997 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.450000000000003 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.439999999999998 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.409 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.140000000000001 110.749 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 71.340000000000003 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.030000000000001 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.561 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 72.329999999999998 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.229999999999997 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.129999999999995 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.430000000000007 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.439999999999998 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 73.420000000000002 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.209999999999994 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.479 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.420000000000002 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.519999999999996 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.010000000000005 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.409999999999997 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.349999999999994 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.299999999999997 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.400000000000006 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.479 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.310000000000002 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.549999999999997 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.310000000000002 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 70.340000000000003 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.109999999999999 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.409999999999997 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.439999999999998 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.404 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.129999999999995 109.797 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.140000000000001 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.430000000000007 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.209999999999994 110.416 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.459 ' HB2' HD13 ' A' ' 114' ' ' LEU . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.019999999999996 110.997 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.099999999999994 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.119999999999997 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.409999999999997 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.140000000000001 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.450000000000003 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 54.219999999999999 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.430000000000007 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 65.120000000000005 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.519999999999996 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.439999999999998 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 72.430000000000007 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.420000000000002 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 100' ' ' MET . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.340000000000003 108.843 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.200000000000003 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 73.030000000000001 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 51.43 110.245 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 120.801 0.25 . . . . 70.230000000000004 111.859 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.040000000000006 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.019999999999996 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.229999999999997 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.099999999999994 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 51.450000000000003 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.430000000000007 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.030000000000001 112.115 -176.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.540000000000006 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.119999999999997 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.430000000000007 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.583 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.310000000000002 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.219999999999999 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.583 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 63.25 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.299999999999997 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 74.319999999999993 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.129999999999995 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 54.109999999999999 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.099999999999994 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.423 ' HB2' HD11 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.099999999999994 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.120000000000005 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.319999999999993 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.239999999999995 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.129999999999995 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.423 HD11 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.530000000000001 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.049999999999997 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.239999999999995 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.404 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 54.219999999999999 110.503 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.420000000000002 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.120000000000005 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.329999999999998 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.430000000000007 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.310000000000002 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.200000000000003 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.219999999999999 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.140000000000001 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.439999999999998 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.020000000000003 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.310000000000002 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.420000000000002 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.010000000000005 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.310000000000002 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 73.519999999999996 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.100000000000001 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.409999999999997 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.210000000000001 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.129999999999995 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.430000000000007 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.424 ' O ' HD13 ' A' ' 60' ' ' LEU . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.140000000000001 111.252 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 62.439999999999998 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.299999999999997 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.439999999999998 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.439999999999998 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.140000000000001 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.219999999999999 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 65.340000000000003 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 64.200000000000003 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.120000000000005 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 62.240000000000002 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.420000000000002 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.400000000000006 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.310000000000002 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.039999999999999 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.310000000000002 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.530000000000001 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.496 ' O ' HD23 ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.219999999999999 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 53.299999999999997 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.239999999999995 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.230000000000004 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 53.200000000000003 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.140000000000001 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.009999999999998 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.420000000000002 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.329999999999998 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.433 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 54.5 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.319999999999993 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.299999999999997 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.209999999999994 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.120000000000005 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.519999999999996 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.420000000000002 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.420000000000002 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 73.329999999999998 110.423 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 73.200000000000003 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.349999999999994 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.349999999999994 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.439999999999998 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.040000000000006 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.419 ' HB2' HD11 ' A' ' 95' ' ' LEU . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.239999999999995 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.540000000000006 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.519999999999996 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.549999999999997 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.549999999999997 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.299999999999997 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.420000000000002 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.540000000000006 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.219999999999999 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.310000000000002 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.310000000000002 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 35.299999999999997 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 C--O 1.237 0.465 0 CA-C-O 121.166 0.402 . . . . 74.310000000000002 112.683 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 51.140000000000001 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 74.219999999999999 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.009999999999998 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.530000000000001 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.420000000000002 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 53.039999999999999 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.6 OUTLIER -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 64.319999999999993 112.066 -177.573 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.109999999999999 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 67' ' ' ALA . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.200000000000003 110.921 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.409 ' CG1' HD11 ' A' ' 43' ' ' ILE . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.25 108.689 176.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.219999999999999 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.209999999999994 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.510000000000005 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.140000000000001 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.329999999999998 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.310000000000002 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.530000000000001 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.488 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.549999999999997 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.519999999999996 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.571 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.040000000000006 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.030000000000001 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.420000000000002 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.310000000000002 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.209999999999994 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.240000000000002 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.539999999999999 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.530000000000001 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 38' ' ' GLU . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.200000000000003 110.199 178.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.439999999999998 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.420000000000002 110.297 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.539999999999999 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.540000000000006 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 72.400000000000006 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.140000000000001 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.209999999999994 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 71.340000000000003 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.530000000000001 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 73.519999999999996 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.310000000000002 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.409999999999997 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 53.439999999999998 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.540000000000006 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.239999999999995 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.109999999999999 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.009999999999998 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.209999999999994 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.420000000000002 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.019999999999996 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.430000000000007 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.310000000000002 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.120000000000005 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 70' ' ' ALA . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 71.040000000000006 112.998 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.340000000000003 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.019999999999996 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.571 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.430000000000007 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.420000000000002 111.628 -178.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.039999999999999 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.149999999999999 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.405 ' CA ' ' HA ' ' A' ' 62' ' ' SER . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.130000000000003 111.78 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.420000000000002 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.119999999999997 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.120000000000005 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.426 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.130000000000003 112.978 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.219999999999999 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.430000000000007 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.049999999999997 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.439999999999998 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.540000000000006 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.340000000000003 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.450000000000003 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.510000000000005 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.140000000000001 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.485 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 73.010000000000005 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.485 ' H ' ' HG3' ' A' ' 84' ' ' MET . 15.7 mm100 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.510000000000005 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.239999999999995 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.409999999999997 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.209999999999994 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.319999999999993 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.120000000000005 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.100000000000001 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.100000000000001 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.450000000000003 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.219999999999999 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.519999999999996 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.329999999999998 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.349999999999994 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.430000000000007 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.150000000000006 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.019999999999996 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.439999999999998 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.129999999999995 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.439999999999998 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.310000000000002 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.520000000000003 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.140000000000001 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.239999999999995 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.229999999999997 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.140000000000001 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.150000000000006 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 55.020000000000003 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.140000000000001 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.519999999999996 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.019999999999996 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.229999999999997 110.178 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.156 0 N-CA-C 111.738 -0.545 . . . . 62.210000000000001 111.738 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -84.03 -45.91 12.58 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.758 0.313 . . . . 71.25 110.502 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -109.41 151.13 27.07 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.067 -0.253 . . . . 74.519999999999996 110.578 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 67.5 mtm -97.49 -174.65 2.98 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 109.673 -0.492 . . . . 53.299999999999997 109.673 178.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -65.15 128.08 93.45 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.513 -0.551 . . . . 70.519999999999996 109.513 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.91 118.04 3.53 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.012 2.474 . . . . 63.340000000000003 112.951 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.01 -25.42 32.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.484 0.659 . . . . 53.32 109.332 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 54.0 mtt180 -138.33 146.61 42.57 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 114.86 -1.064 . . . . 75.109999999999999 109.858 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.7 m -137.03 143.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 116.48 -0.327 . . . . 52.32 110.339 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.8 ttt180 -98.49 112.04 24.2 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 109.197 -0.668 . . . . 63.240000000000002 109.197 176.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.79 145.08 49.44 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-O 121.314 0.578 . . . . 74.25 111.711 -178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -102.12 154.19 19.23 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 108.459 -0.941 . . . . 70.030000000000001 108.459 176.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -136.03 138.86 42.62 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 120.258 -0.577 . . . . 52.219999999999999 112.482 -177.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 22.5 tp -107.21 156.6 18.67 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.796 -0.816 . . . . 71.430000000000007 108.796 177.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.485 HD23 ' CE1' ' A' ' 111' ' ' HIS . 3.3 tm? -142.51 129.51 20.73 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.849 0.357 . . . . 75.120000000000005 110.702 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.3 p -129.41 130.11 67.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 70.209999999999994 109.683 176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HE3' HD11 ' A' ' 15' ' ' LEU . 34.3 mmtp -86.91 170.01 12.0 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.911 0.386 . . . . 72.129999999999995 110.555 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 p80 -157.26 174.36 15.56 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.962 -0.563 . . . . 63.439999999999998 110.146 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -50.15 -50.78 47.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.492 0.495 . . . . 32.100000000000001 111.595 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.423 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.7 mm-40 -80.94 87.2 5.98 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.172 0.511 . . . . 63.149999999999999 110.645 176.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.458 ' HA ' ' HB3' ' A' ' 108' ' ' SER . 74.4 m -154.57 160.96 41.81 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.649 -0.705 . . . . 73.109999999999999 109.967 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.47 ' HG3' ' OG ' ' A' ' 108' ' ' SER . 27.6 mtp180 -69.29 -39.32 78.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.041 0.448 . . . . 74.030000000000001 110.172 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.482 ' HG3' ' OG ' ' A' ' 25' ' ' SER . 12.5 tpp180 -149.39 92.02 4.33 Favored Pre-proline 0 C--N 1.316 -0.878 0 CA-C-N 115.659 -0.701 . . . . 74.040000000000006 109.648 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -71.26 62.37 2.66 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.318 2.679 . . . . 74.010000000000005 112.486 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' A' ' 23' ' ' ARG . 36.7 p -124.48 151.6 44.4 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 115.799 -0.637 . . . . 73.219999999999999 110.035 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.5 p -99.89 -178.27 3.8 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.999 -0.371 . . . . 64.230000000000004 109.999 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.2 p-90 -67.82 -25.53 65.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.264 -0.426 . . . . 74.340000000000003 110.797 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -106.1 6.15 30.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.233 -0.44 . . . . 62.229999999999997 110.652 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 61.43 66.38 0.87 Allowed 'General case' 0 C--O 1.239 0.519 0 CA-C-N 115.379 -0.828 . . . . 74.439999999999998 112.15 179.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -96.58 168.54 10.47 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.595 -0.891 . . . . 74.519999999999996 108.595 175.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -83.52 115.38 22.07 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.038 0.446 . . . . 75.450000000000003 110.507 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.3 mp -110.77 95.96 4.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.399 0.618 . . . . 61.049999999999997 110.359 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.8 p -111.44 -14.42 13.73 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.611 -0.722 . . . . 64.420000000000002 109.779 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 3.0 ptt85 -53.07 130.63 34.62 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.148 -0.933 . . . . 75.230000000000004 111.399 178.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -83.87 176.87 8.59 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.943 -0.571 . . . . 75.099999999999994 110.873 -178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.62 -37.07 82.6 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 116.36 -0.382 . . . . 73.040000000000006 110.41 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -57.14 -37.77 72.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 74.230000000000004 110.611 178.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.452 ' OE1' ' HA ' ' A' ' 34' ' ' ARG . 44.7 mt-10 -79.45 -46.26 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.797 -0.638 . . . . 74.230000000000004 110.563 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.97 -32.35 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 63.32 110.951 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.43 -38.72 84.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.808 -0.633 . . . . 74.0 110.628 178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mt-10 -69.24 -36.25 76.99 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 120.964 0.411 . . . . 71.319999999999993 110.214 179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.35 -51.8 61.54 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.78 -0.645 . . . . 75.030000000000001 109.665 177.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.6 mm -54.75 -56.86 8.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 115.847 -0.615 . . . . 70.019999999999996 111.06 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -56.69 -44.45 81.52 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 116.402 -0.363 . . . . 72.340000000000003 110.968 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.536 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.15 -50.14 71.0 Favored Glycine 0 N--CA 1.443 -0.847 0 C-N-CA 120.868 -0.682 . . . . 53.140000000000001 112.321 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -60.41 -43.22 96.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.519 0.2 . . . . 72.129999999999995 110.809 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.1 mt -56.02 -45.33 80.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 116.227 -0.442 . . . . 74.549999999999997 110.32 178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 78.1 mm-40 -65.92 -45.3 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.868 -0.605 . . . . 72.319999999999993 110.743 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 97.7 mttt -56.83 -46.17 81.86 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.849 0.357 . . . . 73.400000000000006 111.602 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.432 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 84.3 mt -62.88 -38.69 82.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.9 -0.591 . . . . 74.219999999999999 111.407 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -81.63 -18.57 44.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.681 -0.236 . . . . 75.019999999999996 111.606 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.0 m -89.08 -5.98 57.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.969 0.414 . . . . 70.409999999999997 110.576 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.03 18.02 75.67 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.676 -0.773 . . . . 60.030000000000001 112.593 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.37 -53.46 8.69 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.031 0.443 . . . . 71.430000000000007 110.302 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 42.7 mt-10 -137.65 158.4 44.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.656 -0.702 . . . . 64.239999999999995 109.791 -179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -100.95 152.53 20.45 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.505 -0.316 . . . . 72.420000000000002 110.638 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -60.49 -42.05 95.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 73.129999999999995 111.645 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.71 -41.19 98.14 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.073 0.464 . . . . 71.299999999999997 110.331 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 m -69.32 -33.33 72.99 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.788 -0.642 . . . . 72.319999999999993 110.15 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.63 -51.54 41.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.473 -0.785 . . . . 63.020000000000003 110.658 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.482 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -58.02 -37.73 74.88 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 116.037 -0.529 . . . . 60.299999999999997 111.613 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 25.6 m -70.88 -1.98 13.53 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 115.965 -0.562 . . . . 55.109999999999999 112.258 -179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -135.77 -71.36 0.47 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 120.84 0.352 . . . . 75.439999999999998 111.783 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -83.59 71.27 10.36 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.263 0.554 . . . . 72.409999999999997 111.862 -176.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.7 t -154.26 145.78 23.16 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.779 -0.823 . . . . 75.140000000000001 108.779 176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -100.5 8.49 43.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.835 0.35 . . . . 75.400000000000006 110.987 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -107.9 175.26 5.54 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.996 0.427 . . . . 53.210000000000001 110.818 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.9 m -72.35 -6.53 43.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.718 -0.674 . . . . 64.319999999999993 110.644 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.3 m -56.92 -28.3 61.86 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.643 -0.708 . . . . 62.229999999999997 111.006 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -59.11 -31.37 68.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.996 -0.547 . . . . 50.420000000000002 111.728 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -105.38 6.7 32.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.212 0.529 . . . . 74.239999999999995 110.666 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.405 ' C ' ' H ' ' A' ' 74' ' ' GLY . . . -121.75 13.72 10.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 64.319999999999993 110.58 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 73.78 -29.36 0.2 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.001 0.92 . . . . 61.310000000000002 111.517 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 72' ' ' ALA . . . 102.96 -16.51 54.21 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.303 -0.475 . . . . 74.010000000000005 112.014 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.36 135.14 35.66 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.717 0.294 . . . . 73.409999999999997 110.809 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -102.92 -3.17 26.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 70.319999999999993 111.271 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.572 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.79 -171.12 55.08 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.625 -0.798 . . . . 55.439999999999998 111.759 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.13 108.4 18.29 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.928 -0.397 . . . . 71.349999999999994 109.928 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -114.79 154.09 29.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.374 -0.376 . . . . 75.129999999999995 111.019 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 10.3 t -91.28 167.56 12.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.842 -0.617 . . . . 74.329999999999998 110.636 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 -83.77 152.9 24.42 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.732 -0.667 . . . . 73.430000000000007 111.2 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.53 22.11 41.52 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 121.117 -0.563 . . . . 61.350000000000001 111.766 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -121.93 -34.21 3.4 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 111.948 0.351 . . . . 64.099999999999994 111.948 -177.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 61.8 mtt -114.38 -169.34 1.51 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 120.732 0.301 . . . . 62.509999999999998 110.988 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -56.87 135.62 55.78 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.006 -0.543 . . . . 62.210000000000001 110.476 178.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.46 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 8.1 tmtm? -53.54 -53.96 51.08 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-N 116.38 -0.373 . . . . 74.140000000000001 111.273 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.7 Cg_endo -58.7 -26.88 81.42 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.061 1.84 . . . . 71.140000000000001 112.347 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.41 ' HB2' HG21 ' A' ' 106' ' ' THR . 52.8 t80 -73.9 -49.12 26.31 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.851 0.357 . . . . 72.540000000000006 110.122 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.41 ' HA ' ' OG ' ' A' ' 92' ' ' SER . 87.3 mt-10 -69.51 -38.27 77.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.052 -0.522 . . . . 65.230000000000004 110.669 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.88 -35.77 73.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 75.209999999999994 110.767 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.596 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -79.67 -49.85 11.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.989 -0.55 . . . . 71.400000000000006 111.193 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 89' ' ' GLU . 12.1 p -59.88 -45.85 91.17 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.102 0.408 . . . . 71.040000000000006 112.102 -177.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -72.32 -10.65 60.06 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.807 0.299 . . . . 74.120000000000005 111.807 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -97.64 -7.71 30.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.985 0.422 . . . . 73.129999999999995 110.78 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.0 mt -86.34 158.34 19.68 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.092 -0.504 . . . . 73.230000000000004 110.13 179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.507 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 21.2 mmt180 -103.94 171.26 7.45 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.018 -0.537 . . . . 73.519999999999996 110.007 178.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.1 m -65.43 105.96 1.29 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.887 0.375 . . . . 74.340000000000003 110.393 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 101.98 -1.04 51.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.933 -0.651 . . . . 74.140000000000001 111.908 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.507 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 9.6 tp10 -91.7 150.95 20.87 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 110.129 -0.323 . . . . 74.400000000000006 110.129 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.1 ttp -131.44 143.3 50.34 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.113 -0.494 . . . . 71.209999999999994 110.404 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 86.2 p -82.68 -171.08 3.31 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.311 -0.404 . . . . 63.539999999999999 110.598 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -108.0 -147.41 13.09 Favored Glycine 0 N--CA 1.438 -1.214 0 N-CA-C 110.941 -0.864 . . . . 54.420000000000002 110.941 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.26 97.82 0.88 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.647 2.231 . . . . 73.010000000000005 111.445 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.2 t -100.15 123.05 52.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.224 -0.444 . . . . 73.349999999999994 110.71 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HG12 ' A' ' 110' ' ' ILE . 44.0 m-85 -101.19 112.01 24.37 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 116.305 -0.407 . . . . 75.340000000000003 110.848 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.41 HG21 ' HB2' ' A' ' 88' ' ' PHE . 45.3 p -125.12 -14.32 6.58 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 121.518 0.675 . . . . 74.439999999999998 109.754 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -135.21 -157.41 0.8 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.999 -1.0 . . . . 73.530000000000001 108.435 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.47 ' OG ' ' HG3' ' A' ' 22' ' ' ARG . 14.3 m -73.67 -38.76 64.83 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.679 -0.489 . . . . 51.210000000000001 109.679 177.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -91.81 173.6 36.77 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.916 -0.659 . . . . 63.140000000000001 112.396 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.471 HG12 ' CZ ' ' A' ' 105' ' ' PHE . 18.6 mt -91.55 137.81 21.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.031 -0.359 . . . . 72.319999999999993 110.031 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 92.4 m-70 -117.15 148.11 41.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.907 0.384 . . . . 61.030000000000001 111.052 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 35.0 mt -121.28 137.56 54.54 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 N-CA-C 107.554 -1.276 . . . . 75.019999999999996 107.554 173.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 57.2 mt -117.02 130.54 71.77 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-O 120.796 0.332 . . . . 53.100000000000001 111.16 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.4 tp -124.25 120.63 32.77 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.1 -0.5 . . . . 74.299999999999997 109.749 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -86.13 106.2 17.08 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.603 -0.439 . . . . 73.420000000000002 110.217 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.6 m -73.52 -38.95 65.14 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.873 -0.603 . . . . 72.239999999999995 110.77 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.451 -0.785 . . . . 75.340000000000003 110.495 -179.131 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.405 0 N-CA-C 111.707 -0.557 . . . . 73.129999999999995 111.707 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 m -99.5 134.16 42.77 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.872 0.367 . . . . 62.350000000000001 111.055 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -154.61 132.78 11.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.083 -0.508 . . . . 74.120000000000005 110.414 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.454 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 46.1 ttm -113.34 148.32 35.96 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.141 -0.481 . . . . 70.109999999999999 110.246 -178.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.454 ' HB3' ' O ' ' A' ' 4' ' ' MET . 42.0 tt0 73.46 138.07 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.557 0 O-C-N 123.858 0.724 . . . . 64.209999999999994 111.271 178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -54.58 116.81 3.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.519 2.146 . . . . 72.349999999999994 111.138 177.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.6 77.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.038 -0.528 . . . . 35.329999999999998 111.943 -177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.8 mtt180 -131.26 123.96 29.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.947 0.403 . . . . 74.209999999999994 111.067 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -126.73 148.48 31.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 116.124 -0.489 . . . . 43.109999999999999 110.249 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 69.8 ttt180 -101.65 112.48 25.06 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.692 -0.484 . . . . 73.439999999999998 109.692 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.3 m -127.83 143.45 51.12 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.998 0.428 . . . . 74.140000000000001 111.262 -178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.21 144.71 26.77 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.484 -0.932 . . . . 52.450000000000003 108.484 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -135.99 157.4 46.92 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.424 0.528 . . . . 74.120000000000005 112.424 -176.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.7 tt -134.3 144.23 48.2 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.387 -0.968 . . . . 72.109999999999999 108.387 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.428 HD23 ' HB2' ' A' ' 67' ' ' ALA . 38.0 tp -133.05 118.97 19.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.755 0.312 . . . . 73.430000000000007 111.197 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -114.38 133.47 60.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 CA-C-N 116.002 -0.544 . . . . 73.200000000000003 110.361 178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.437 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 43.3 mmtm -76.83 156.87 31.92 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.199 -0.455 . . . . 60.200000000000003 111.384 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -120.28 149.83 41.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.503 -0.771 . . . . 53.539999999999999 109.796 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 7.4 t -55.98 -55.12 36.51 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.441 0.463 . . . . 51.329999999999998 111.858 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.57 85.04 7.32 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.089 0.471 . . . . 74.439999999999998 110.905 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.9 p -145.94 178.23 8.35 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.698 -0.683 . . . . 63.439999999999998 109.814 179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -76.02 -35.42 59.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.679 -0.408 . . . . 74.129999999999995 110.654 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -130.87 82.53 63.99 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.292 -0.413 . . . . 75.25 110.822 178.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.46 ' C ' HG12 ' A' ' 32' ' ' ILE . 72.3 Cg_endo -85.02 70.99 5.25 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 122.504 2.136 . . . . 72.430000000000007 111.801 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.7 m -146.15 133.65 20.85 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.02 -0.536 . . . . 61.43 111.326 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.439 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 95.1 p -131.36 -174.36 3.37 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.292 -0.633 . . . . 73.319999999999993 109.292 177.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 17.0 p-90 -87.36 1.03 54.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.327 0.584 . . . . 63.350000000000001 109.794 176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.2 mmt180 -105.95 -49.63 3.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.269 -0.878 . . . . 72.109999999999999 109.574 177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.501 ' HB2' HD13 ' A' ' 32' ' ' ILE . 93.1 mt-30 -119.19 125.16 48.55 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.855 -0.611 . . . . 62.340000000000003 109.982 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.71 -31.93 72.91 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.235 -1.024 . . . . 72.200000000000003 108.235 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -130.89 108.52 9.9 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 114.772 -1.104 . . . . 62.119999999999997 109.097 175.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.502 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 50.8 mm -59.29 116.84 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-N 116.088 -0.505 . . . . 71.310000000000002 110.887 -178.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 37.9 p -104.38 -8.21 19.36 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 116.001 -0.545 . . . . 74.140000000000001 111.634 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.3 ptp85 -71.0 122.05 19.3 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 109.756 -0.461 . . . . 52.32 109.756 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 38' ' ' GLU . 15.3 t -77.47 168.12 20.52 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.379 -0.373 . . . . 74.530000000000001 111.122 -177.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.4 tttm -50.19 -54.9 17.71 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.611 0.765 . . . . 74.040000000000006 112.793 -176.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.24 -25.59 60.78 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 111.872 0.323 . . . . 75.239999999999995 111.872 -177.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 35' ' ' THR . 40.4 tt0 -70.68 -44.0 67.89 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 109.866 -0.42 . . . . 63.140000000000001 109.866 178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.495 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.67 -36.97 80.03 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.468 -0.567 . . . . 53.420000000000002 109.468 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 67.5 tp -63.37 -52.64 60.85 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.503 -0.771 . . . . 74.109999999999999 110.372 178.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -60.97 -38.55 86.31 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.32 -0.4 . . . . 70.040000000000006 111.49 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -58.94 -46.48 87.88 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.078 -0.51 . . . . 73.120000000000005 109.8 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.7 mm -68.7 -43.66 82.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.673 -0.694 . . . . 63.340000000000003 110.581 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -56.11 -52.11 65.5 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.389 -0.369 . . . . 64.430000000000007 110.993 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.84 -43.18 96.77 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.056 -0.593 . . . . 75.209999999999994 112.154 179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.512 ' O ' HG13 ' A' ' 50' ' ' ILE . 12.7 m-30 -64.54 -43.96 92.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.399 0.142 . . . . 54.340000000000003 110.722 179.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 40.4 mt -56.07 -42.53 72.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 120.939 0.4 . . . . 43.399999999999999 110.716 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.5 mm100 -60.74 -40.32 91.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.909 -0.587 . . . . 72.349999999999994 110.588 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -71.48 -44.2 65.17 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.226 -0.443 . . . . 71.120000000000005 110.858 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 46' ' ' TYR . 78.3 mt -58.73 -48.4 86.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.562 -0.29 . . . . 71.310000000000002 111.47 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.18 -26.46 68.81 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.791 0.293 . . . . 62.130000000000003 111.791 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.3 m -91.46 -4.17 55.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.034 0.445 . . . . 75.25 111.259 -179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 77.02 27.74 59.77 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.869 -0.681 . . . . 51.549999999999997 111.708 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -106.64 8.5 31.16 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 122.681 0.393 . . . . 75.409999999999997 111.26 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -159.16 153.17 23.42 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.794 -0.363 . . . . 72.209999999999994 111.079 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.429 ' O ' HD13 ' A' ' 60' ' ' LEU . 36.8 m-20 -100.69 114.24 27.8 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.157 -0.474 . . . . 71.5 110.463 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -57.45 -43.38 83.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.151 0.5 . . . . 75.420000000000002 110.255 178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 58' ' ' GLU . 1.8 mp0 -58.12 -50.24 74.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.409 -0.814 . . . . 71.310000000000002 110.809 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 t -61.41 -37.28 82.88 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.823 -0.626 . . . . 71.430000000000007 110.623 -178.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.429 HD13 ' O ' ' A' ' 56' ' ' ASP . 5.0 mp -62.84 -41.78 99.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.869 0.366 . . . . 73.239999999999995 110.343 178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -66.33 -44.02 84.48 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.035 -0.53 . . . . 74.150000000000006 110.08 178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.2 m -75.84 8.31 3.19 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.784 0.661 . . . . 63.149999999999999 112.784 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -134.09 -47.51 0.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.803 0.668 . . . . 51.229999999999997 112.803 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -99.22 -25.16 14.6 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.062 0.393 . . . . 71.439999999999998 112.062 -176.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 9.9 t -80.43 135.54 36.17 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.615 -0.513 . . . . 75.409999999999997 109.615 179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 26' ' ' SER . 8.1 p-10 -100.11 0.22 40.28 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.276 -0.42 . . . . 73.420000000000002 111.119 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.428 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -86.42 177.53 7.4 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 116.145 -0.479 . . . . 63.409999999999997 110.591 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.4 m -64.25 -11.67 33.71 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.249 0.547 . . . . 61.43 110.285 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.4 m -58.34 -33.08 69.14 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.34 -0.845 . . . . 61.130000000000003 110.11 177.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.07 -43.52 91.75 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.99 -0.55 . . . . 62.210000000000001 111.198 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -72.87 -30.81 64.27 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.106 -0.497 . . . . 73.450000000000003 111.505 -177.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.86 5.69 48.7 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.099 0.407 . . . . 62.420000000000002 112.099 -177.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.449 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 7.0 mpt_? 63.33 23.01 13.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-O 121.062 0.458 . . . . 74.329999999999998 111.53 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.1 -28.98 9.32 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 115.979 -0.555 . . . . 72.430000000000007 113.062 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -63.0 132.67 52.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.19 0.519 . . . . 51.340000000000003 112.075 -177.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 49.4 mt -114.23 -8.48 12.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.446 -0.797 . . . . 61.210000000000001 110.994 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.43 -172.45 54.59 Favored Glycine 0 N--CA 1.438 -1.205 0 C-N-CA 119.995 -1.098 . . . . 75.319999999999993 110.52 -174.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.08 112.93 19.59 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.012 0.406 . . . . 62.549999999999997 110.562 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -116.51 158.54 23.45 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.256 -0.429 . . . . 54.310000000000002 110.395 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 5.7 t -105.59 175.01 5.64 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.322 -0.399 . . . . 74.400000000000006 109.953 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 19.4 mtp180 -71.69 152.01 43.17 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.933 0.397 . . . . 71.25 110.602 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.52 0.96 87.98 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.942 -0.572 . . . . 74.439999999999998 111.84 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -118.97 14.8 13.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.169 0.509 . . . . 62.140000000000001 109.924 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 41.2 tpp -143.59 159.37 42.57 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.776 -0.647 . . . . 65.109999999999999 110.241 -176.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -54.99 138.43 43.78 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 109.403 -0.592 . . . . 74.040000000000006 109.403 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 15.7 tppt? -58.73 -50.31 88.73 Favored Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 112.373 0.509 . . . . 62.409999999999997 112.373 -178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 19.1 Cg_endo -59.88 -25.78 80.41 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.185 1.923 . . . . 73.019999999999996 112.174 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.617 ' CE2' HG12 ' A' ' 113' ' ' ILE . 18.0 t80 -84.99 -47.59 10.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.989 -0.55 . . . . 65.120000000000005 109.531 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -56.02 -48.51 75.81 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 123.886 0.875 . . . . 75.549999999999997 111.299 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -56.16 -41.09 74.88 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.829 -0.623 . . . . 55.329999999999998 111.563 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -82.34 -43.65 17.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.995 -0.548 . . . . 72.430000000000007 112.172 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.2 p -59.66 -47.09 87.0 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.353 0.501 . . . . 60.329999999999998 112.353 -177.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -73.22 -10.15 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.84 0.352 . . . . 74.099999999999994 111.681 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -91.15 -19.54 22.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.857 0.36 . . . . 51.200000000000003 110.439 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.9 mt -81.92 154.8 25.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.541 . . . . 71.319999999999993 110.519 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -92.22 170.18 10.01 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 110.096 178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 117' ' ' GLU . 90.6 m -67.58 120.93 14.81 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.823 0.344 . . . . 71.540000000000006 110.364 178.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.31 34.93 9.09 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 110.817 -0.913 . . . . 61.530000000000001 110.817 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -129.01 148.15 50.94 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.227 -0.286 . . . . 71.439999999999998 110.227 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 113' ' ' ILE . 53.3 ttp -131.78 133.34 44.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.346 -0.388 . . . . 70.329999999999998 110.284 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.431 ' HB3' HD11 ' A' ' 95' ' ' LEU . 65.8 p -85.12 -171.72 3.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.351 -0.386 . . . . 55.32 110.555 -179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -93.34 -161.88 36.1 Favored Glycine 0 N--CA 1.431 -1.649 0 C-N-CA 120.618 -0.801 . . . . 55.43 111.099 176.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -70.7 106.75 1.89 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.591 2.194 . . . . 70.329999999999998 111.643 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 87.7 t -83.01 116.29 26.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.577 -0.527 . . . . 74.430000000000007 109.577 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -83.38 126.29 32.57 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.87 -0.604 . . . . 72.409999999999997 111.047 -176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.451 ' OG1' ' HD2' ' A' ' 111' ' ' HIS . 24.1 p -137.21 -169.07 2.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.638 -0.71 . . . . 65.239999999999995 110.235 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -73.83 -51.44 16.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.018 0.437 . . . . 74.129999999999995 111.141 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.6 m -66.39 -24.15 66.43 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.94 -0.573 . . . . 64.349999999999994 111.571 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 151.76 -135.02 4.85 Favored Glycine 0 N--CA 1.438 -1.177 0 C-N-CA 120.309 -0.948 . . . . 75.340000000000003 112.388 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 75.6 mt -107.04 129.99 59.82 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-O 120.91 0.386 . . . . 72.450000000000003 110.612 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.617 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 53.3 m-70 -111.85 137.93 49.14 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.773 -0.648 . . . . 73.150000000000006 110.101 177.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.7 mt -108.38 143.23 19.12 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 N-CA-C 108.449 -0.945 . . . . 75.109999999999999 108.449 175.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.617 HG12 ' CE2' ' A' ' 88' ' ' PHE . 43.2 mt -119.72 117.46 53.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 120.802 0.334 . . . . 64.400000000000006 111.125 -178.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 100' ' ' MET . 57.2 tp -123.98 103.51 8.35 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 109.328 -0.619 . . . . 74.329999999999998 109.328 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -74.42 107.83 6.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.013 0.435 . . . . 55.32 110.715 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.2 m -74.51 -50.56 17.67 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.527 -0.76 . . . . 71.530000000000001 110.722 -179.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.477 ' HA ' HG23 ' A' ' 97' ' ' THR . 43.7 mt-10 . . . . . 0 C--O 1.252 1.212 0 CA-C-O 118.673 -0.679 . . . . 50.030000000000001 110.143 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.217 0 N-CA-C 112.056 -0.418 . . . . 72.150000000000006 112.056 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 m -76.24 141.5 41.7 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.921 0.391 . . . . 73.540000000000006 111.289 -178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -149.36 22.81 0.93 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.979 -0.555 . . . . 64.319999999999993 110.482 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.3 mtp -132.36 169.33 16.65 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.926 -0.579 . . . . 72.140000000000001 110.553 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -82.07 126.9 73.67 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.438 -0.346 . . . . 71.530000000000001 110.303 177.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.9 161.46 36.41 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.048 2.499 . . . . 72.219999999999999 112.865 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.401 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -101.83 -31.37 10.77 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.94 -0.573 . . . . 75.319999999999993 110.893 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 86.8 mtt180 -138.55 129.67 27.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.099 -0.5 . . . . 62.119999999999997 110.298 179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 35.4 m -136.3 160.78 38.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 116.553 -0.294 . . . . 73.230000000000004 110.352 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 72.9 ttt180 -108.52 117.47 34.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.486 -0.324 . . . . 72.109999999999999 110.349 179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 58.6 m -136.8 148.85 47.42 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.003 0.43 . . . . 73.340000000000003 111.497 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.2 m -97.45 144.09 27.52 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 108.965 -0.754 . . . . 74.450000000000003 108.965 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -125.9 146.35 49.88 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.543 0.572 . . . . 74.540000000000006 112.543 -176.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.49 HD23 ' N ' ' A' ' 15' ' ' LEU . 8.6 tt -137.76 144.94 41.87 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 107.215 -1.402 . . . . 65.450000000000003 107.215 175.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' N ' HD23 ' A' ' 14' ' ' LEU . 47.1 tp -141.85 129.19 21.16 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 120.655 0.264 . . . . 51.450000000000003 111.348 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 94.9 t -112.57 120.36 62.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-O 120.83 0.348 . . . . 70.519999999999996 110.088 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -69.09 161.27 29.41 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.62 . . . . 74.319999999999993 111.66 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -130.2 149.28 51.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.517 -0.765 . . . . 75.430000000000007 109.728 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.5 t -53.29 -54.55 34.76 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 123.695 0.622 . . . . 64.099999999999994 112.322 -176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -83.45 81.87 8.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.939 0.399 . . . . 72.420000000000002 110.037 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -143.74 -170.84 3.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.491 -0.559 . . . . 50.130000000000003 109.491 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -73.02 -42.95 62.67 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.519 -0.549 . . . . 71.310000000000002 109.519 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -141.55 99.97 6.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 115.481 -0.781 . . . . 71.409999999999997 110.075 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.3 59.89 7.15 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 122.829 2.353 . . . . 52.039999999999999 112.807 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.7 p -151.56 131.5 13.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.369 -0.378 . . . . 75.230000000000004 110.813 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 90.5 p -112.04 -173.49 2.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.93 -0.396 . . . . 75.0 109.93 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.444 ' CD1' ' HG2' ' A' ' 28' ' ' ARG . 1.5 p-90 -84.01 -3.79 58.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 74.209999999999994 110.029 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.466 ' HA ' ' NE ' ' A' ' 28' ' ' ARG . 4.4 mmp_? -110.77 -38.49 5.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.02 -0.536 . . . . 74.430000000000007 110.972 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 6.6 tp60 -127.72 123.55 35.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.801 0.334 . . . . 63.229999999999997 110.749 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.89 -17.7 59.68 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.997 0.427 . . . . 61.140000000000001 110.969 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 21.4 ptmt -126.87 95.29 4.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.026 -0.533 . . . . 70.219999999999999 111.376 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.452 HG23 ' HG2' ' A' ' 34' ' ' ARG . 47.3 mm -80.92 99.32 4.3 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 N-CA-C 109.251 -0.648 . . . . 61.420000000000002 109.251 177.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 m -94.43 -19.32 20.69 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.642 -0.708 . . . . 43.140000000000001 110.335 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.452 ' HG2' HG23 ' A' ' 32' ' ' ILE . 8.4 ptp180 -64.19 134.81 55.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.872 -0.603 . . . . 74.409999999999997 110.282 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -98.15 -174.43 2.85 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 116.48 -0.327 . . . . 71.409999999999997 110.423 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.26 -57.18 10.5 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.087 0.555 . . . . 60.219999999999999 112.194 -177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -59.63 -38.22 80.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.445 -0.343 . . . . 75.540000000000006 111.651 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 25.1 mm-40 -66.44 -46.67 75.66 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.294 -0.412 . . . . 73.510000000000005 110.795 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.18 -37.72 88.35 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.969 -0.56 . . . . 74.010000000000005 110.302 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.39 -41.96 98.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.786 -0.643 . . . . 74.420000000000002 111.233 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -63.11 -37.68 88.19 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.935 0.397 . . . . 65.409999999999997 110.2 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 94.2 mt -65.86 -48.74 70.59 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.835 -0.621 . . . . 73.299999999999997 109.972 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 39' ' ' ALA . 34.5 mm -54.06 -53.77 25.7 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.786 -0.643 . . . . 71.120000000000005 110.956 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.516 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 33.0 m-80 -59.14 -40.41 85.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 73.420000000000002 111.127 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.6 -41.83 98.98 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.929 -0.653 . . . . 32.25 111.759 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.5 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.1 m-85 -67.45 -42.49 82.99 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.363 -0.236 . . . . 73.5 110.363 178.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 43' ' ' ILE . 72.9 mt -55.55 -41.72 65.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.413 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.2 mm-40 -57.77 -50.16 74.17 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.153 0.501 . . . . 71.319999999999993 109.968 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -62.46 -36.57 82.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.729 -0.669 . . . . 75.400000000000006 111.565 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 46' ' ' TYR . 86.9 mt -65.17 -50.24 75.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.542 -0.299 . . . . 75.200000000000003 110.556 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt -63.47 -37.78 88.62 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.905 0.383 . . . . 72.329999999999998 110.855 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 44.9 m -75.56 -16.74 60.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 111.32 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 72.38 40.13 55.55 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.806 -0.711 . . . . 40.299999999999997 112.086 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -81.41 -52.76 6.93 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 120.878 0.371 . . . . 72.329999999999998 110.984 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -127.39 159.19 35.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.191 -0.458 . . . . 74.409999999999997 111.105 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.0 135.15 35.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.746 -0.661 . . . . 64.239999999999995 110.923 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -57.92 -37.91 74.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.881 -0.6 . . . . 74.230000000000004 112.344 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 51.1 mt-10 -61.01 -33.0 72.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.723 0.297 . . . . 73.430000000000007 111.533 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.1 t -72.43 -43.22 64.13 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.976 0.417 . . . . 74.239999999999995 109.92 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.9 mp -64.32 -42.82 96.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.1 -0.5 . . . . 72.430000000000007 110.814 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.56 -11.22 52.01 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 111.839 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.4 m -104.22 -54.24 2.58 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.238 -0.437 . . . . 54.140000000000001 110.714 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -68.76 -38.83 80.37 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.454 0.538 . . . . 71.219999999999999 112.454 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -130.55 84.32 2.19 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.073 0.463 . . . . 52.409999999999997 111.074 -177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 t -165.33 -171.49 2.18 Favored 'General case' 0 N--CA 1.44 -0.972 0 CA-C-N 115.64 -0.709 . . . . 73.409999999999997 109.498 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -71.96 -76.36 0.11 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 111.905 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.436 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . . . -171.61 -63.02 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 120.957 0.408 . . . . 42.399999999999999 111.922 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -56.42 -19.44 14.97 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.643 0.777 . . . . 73.129999999999995 113.087 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 p -75.66 -33.93 60.46 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.927 0.343 . . . . 70.430000000000007 111.927 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.97 -55.06 39.97 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.877 0.695 . . . . 74.310000000000002 112.877 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -59.37 -29.64 67.84 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.204 0.446 . . . . 63.329999999999998 112.204 -177.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.52 -4.75 44.25 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.626 0.25 . . . . 62.149999999999999 111.049 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 58' ' ' GLU . 9.9 mpt_? 59.66 35.46 22.39 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.526 0.679 . . . . 75.340000000000003 110.514 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 87.78 -50.78 4.02 Favored Glycine 0 N--CA 1.438 -1.211 0 CA-C-N 115.502 -0.772 . . . . 70.230000000000004 112.57 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -59.92 127.33 31.39 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.24 0.459 . . . . 74.439999999999998 112.24 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 59.7 mt -97.9 -13.15 21.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.009 -0.541 . . . . 53.509999999999998 110.556 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.55 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 80.75 -168.31 51.05 Favored Glycine 0 N--CA 1.437 -1.281 0 C-N-CA 120.352 -0.928 . . . . 72.420000000000002 110.942 -176.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -80.23 109.09 14.37 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.804 0.335 . . . . 71.109999999999999 110.61 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 41.9 p90 -116.4 152.22 34.4 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.373 -0.376 . . . . 70.019999999999996 110.848 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.401 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 27.8 t -88.85 152.84 21.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.884 -0.598 . . . . 74.430000000000007 111.175 -178.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.413 ' HG3' ' H ' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -74.56 161.1 30.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.663 . . . . 75.439999999999998 111.418 178.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.52 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 81.97 20.48 63.08 Favored Glycine 0 N--CA 1.44 -1.06 0 N-CA-C 110.9 -0.88 . . . . 75.319999999999993 110.9 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -135.19 -23.31 1.5 Allowed 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.186 0.439 . . . . 74.120000000000005 112.186 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.9 tpp -106.45 162.76 13.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.689 -0.232 . . . . 72.040000000000006 110.412 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -51.6 124.99 13.48 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.035 -0.728 . . . . 64.310000000000002 109.035 177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.6 tptt -47.65 -51.73 43.08 Favored Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 113.513 0.931 . . . . 52.210000000000001 113.513 -175.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.9 Cg_endo -55.36 -34.47 88.96 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 122.057 1.838 . . . . 64.329999999999998 112.302 179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.521 ' CE2' HG12 ' A' ' 113' ' ' ILE . 16.6 t80 -82.37 -47.52 12.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.437 0.637 . . . . 61.299999999999997 110.065 -179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.1 tt0 -62.43 -53.65 51.79 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.209 -0.905 . . . . 63.240000000000002 111.506 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -63.17 -25.9 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.227 -0.442 . . . . 73.540000000000006 110.972 -178.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.635 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -76.69 -52.12 10.23 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.47 -0.332 . . . . 65.209999999999994 110.539 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 11.1 p -60.12 -45.06 94.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.086 -0.506 . . . . 71.319999999999993 111.982 -178.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -68.68 -23.39 64.39 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.646 -0.252 . . . . 64.129999999999995 111.66 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -84.91 -15.64 43.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.768 0.318 . . . . 74.450000000000003 111.247 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 88.2 mt -78.46 -168.29 1.31 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.095 0.474 . . . . 60.119999999999997 110.412 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 12.9 ptp180 -126.59 172.29 10.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.273 -0.64 . . . . 63.229999999999997 109.273 177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.481 HG23 ' HA ' ' A' ' 117' ' ' GLU . 54.9 m -64.88 117.9 8.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.804 0.335 . . . . 75.040000000000006 110.266 177.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.02 42.29 7.18 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.303 -0.719 . . . . 75.430000000000007 111.303 -178.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -129.17 149.04 51.15 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.737 0.303 . . . . 74.420000000000002 110.927 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.8 ttp -126.32 136.54 52.86 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.071 -0.513 . . . . 71.420000000000002 109.955 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.518 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 78.1 p -88.57 -174.43 4.56 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.266 -0.424 . . . . 72.109999999999999 110.774 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.82 -166.48 39.86 Favored Glycine 0 N--CA 1.439 -1.144 0 N-CA-C 110.8 -0.92 . . . . 73.040000000000006 110.8 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.11 116.01 4.54 Favored 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 122.344 2.029 . . . . 62.450000000000003 112.246 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.5 t -94.37 115.35 32.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.36 -0.382 . . . . 72.209999999999994 110.062 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -89.56 115.03 26.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.353 -0.385 . . . . 63.5 111.681 -177.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.8 p -127.66 173.88 9.54 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.787 -0.449 . . . . 75.409999999999997 109.787 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -64.3 -32.11 73.59 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.922 0.392 . . . . 62.210000000000001 110.981 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 9.7 m -79.83 -5.5 55.57 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.147 -0.478 . . . . 62.539999999999999 111.376 -179.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 127.13 -161.86 21.28 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.968 -0.634 . . . . 41.439999999999998 111.979 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 51.7 mt -98.65 131.33 46.02 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.944 0 N-CA-C 110.271 -0.27 . . . . 72.519999999999996 110.271 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 84.9 m-70 -109.51 147.98 31.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.298 -0.41 . . . . 75.25 111.277 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.7 mt -115.82 138.13 47.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 107.677 -1.231 . . . . 63.229999999999997 107.677 173.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.521 HG12 ' CE2' ' A' ' 88' ' ' PHE . 60.6 mt -118.67 117.64 55.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-O 120.774 0.321 . . . . 74.109999999999999 111.499 -177.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.2 tp -119.08 99.49 6.76 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.06 -0.719 . . . . 51.130000000000003 109.06 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -77.69 112.12 14.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 71.030000000000001 110.871 -177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.3 m -77.54 -49.17 15.23 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 115.431 -0.804 . . . . 74.530000000000001 110.481 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.513 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 50.4 mt-10 . . . . . 0 C--O 1.255 1.359 0 CA-C-O 118.618 -0.706 . . . . 65.25 110.46 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.223 0 N-CA-C 111.796 -0.522 . . . . 60.119999999999997 111.796 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 m -68.24 111.71 4.71 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.754 0.312 . . . . 72.519999999999996 110.923 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -88.47 -29.6 20.02 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.907 -0.405 . . . . 75.040000000000006 109.907 178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 63.3 mtt -90.27 167.63 12.53 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.916 -0.583 . . . . 51.439999999999998 110.111 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.09 144.01 27.29 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 109.433 -0.58 . . . . 74.209999999999994 109.433 176.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HG2' HH22 ' A' ' 115' ' ' ARG . 32.3 Cg_exo -59.48 150.34 76.16 Favored 'Trans proline' 0 C--O 1.238 0.511 0 C-N-CA 122.701 2.267 . . . . 55.240000000000002 112.255 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -78.84 -26.96 44.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.947 -0.57 . . . . 64.150000000000006 110.104 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 98.9 mtt180 -126.15 128.16 46.86 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.612 -0.722 . . . . 71.230000000000004 110.438 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.3 m -124.43 144.62 33.65 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-N 116.144 -0.48 . . . . 55.420000000000002 109.911 177.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.519 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 80.1 ttt180 -102.71 106.99 17.73 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.502 -0.555 . . . . 63.409999999999997 109.502 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 62.4 m -123.48 140.45 52.99 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.146 0.498 . . . . 75.349999999999994 111.758 -177.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 19.4 m -99.29 139.24 35.23 Favored 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 108.772 -0.825 . . . . 74.239999999999995 108.772 176.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.478 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.3 p80 -122.77 137.3 54.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.288 0.477 . . . . 71.540000000000006 112.288 -176.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.7 tt -121.02 123.87 43.44 Favored 'General case' 0 C--N 1.312 -1.024 0 N-CA-C 107.807 -1.182 . . . . 73.340000000000003 107.807 175.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.6 tp -117.95 125.69 50.9 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.938 0.399 . . . . 73.140000000000001 111.501 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.432 HG12 ' HB ' ' A' ' 110' ' ' ILE . 10.6 p -114.89 138.66 44.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.501 -0.772 . . . . 75.0 109.355 177.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -102.04 -178.9 3.84 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.105 0.479 . . . . 73.099999999999994 111.435 -178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.473 ' CD2' ' HA ' ' A' ' 36' ' ' LYS . 46.8 m80 -133.77 176.06 8.9 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.299 -0.63 . . . . 71.409999999999997 109.299 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.5 t -83.52 7.64 16.5 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.345 -0.983 . . . . 73.239999999999995 108.345 173.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 36' ' ' LYS . 51.3 mt-30 -120.92 -3.33 9.66 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.106 -0.952 . . . . 60.340000000000003 111.165 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.53 ' HB3' ' O ' ' A' ' 108' ' ' SER . 4.4 p -81.17 161.76 23.91 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.969 -0.292 . . . . 64.340000000000003 110.693 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -50.42 -42.86 54.46 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.611 0.569 . . . . 74.340000000000003 111.683 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -111.72 96.44 32.83 Favored Pre-proline 0 N--CA 1.444 -0.748 0 CA-C-N 116.44 -0.345 . . . . 63.439999999999998 110.217 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.78 40.07 0.81 Allowed 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.911 2.407 . . . . 70.540000000000006 111.648 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -145.66 140.45 27.31 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.921 -0.581 . . . . 73.109999999999999 109.511 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.501 ' HB3' HD11 ' A' ' 32' ' ' ILE . 95.2 p -118.67 -172.21 2.24 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.914 0.388 . . . . 65.030000000000001 110.183 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.8 p-90 -95.58 -3.47 46.36 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.751 -0.833 . . . . 64.409999999999997 108.751 176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.41 -38.81 8.66 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.151 -0.932 . . . . 73.519999999999996 110.219 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -137.47 147.13 45.05 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 115.927 -0.579 . . . . 75.329999999999998 109.889 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.87 -24.85 64.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 44.329999999999998 112.153 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -152.06 151.25 30.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 120.952 0.406 . . . . 73.140000000000001 111.265 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.501 HD11 ' HB3' ' A' ' 26' ' ' SER . 49.1 mm -91.41 123.44 43.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.11 0 CA-C-N 115.663 -0.699 . . . . 53.229999999999997 109.299 177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.7 p -103.97 -11.13 17.61 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.758 0.313 . . . . 74.450000000000003 111.562 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.473 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 7.9 ptp85 -76.77 129.9 36.94 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-O 121.112 0.482 . . . . 72.0 110.46 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -81.38 -174.64 5.05 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 116.432 -0.349 . . . . 71.25 110.184 178.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 18' ' ' HIS . 39.5 ttmt -54.33 -62.11 1.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.203 0.446 . . . . 63.130000000000003 112.203 -177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -61.28 -31.48 71.3 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.418 0.525 . . . . 72.450000000000003 112.418 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.4 mm-40 -60.9 -50.86 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.797 0.332 . . . . 53.530000000000001 111.387 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.89 -33.24 74.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.095 -0.502 . . . . 54.020000000000003 111.156 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.78 -46.53 84.83 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.819 -0.437 . . . . 73.030000000000001 109.819 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -66.26 -31.13 71.76 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.091 -0.504 . . . . 74.030000000000001 110.668 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 82.1 mt -66.69 -43.19 85.06 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.79 -0.448 . . . . 73.140000000000001 109.79 176.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 39' ' ' ALA . 37.0 mm -58.89 -48.93 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.047 -0.524 . . . . 73.430000000000007 110.097 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.499 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.1 m-20 -55.99 -43.66 77.86 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.968 -0.56 . . . . 62.409999999999997 110.113 176.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.09 -48.69 84.72 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.688 -0.687 . . . . 40.020000000000003 112.069 178.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 17.9 m-85 -55.58 -51.4 67.24 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 109.843 -0.429 . . . . 61.219999999999999 109.843 178.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.4 mt -57.07 -47.6 83.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.733 -0.667 . . . . 71.450000000000003 111.021 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.8 mm-40 -59.64 -44.33 93.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.388 -0.369 . . . . 73.010000000000005 110.768 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -65.75 -40.8 92.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.629 -0.26 . . . . 71.010000000000005 111.215 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 91.0 mt -64.36 -47.38 89.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.848 0.356 . . . . 74.0 110.725 178.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -67.06 -35.22 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.340000000000003 111.22 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.5 t -74.45 -22.98 58.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.353 -0.385 . . . . 71.549999999999997 110.78 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 93.93 20.52 30.76 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.754 -0.736 . . . . 51.25 112.43 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -83.78 -61.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.078 0.466 . . . . 73.450000000000003 110.484 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -107.44 169.16 8.75 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.664 -0.698 . . . . 60.340000000000003 111.141 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.418 ' O ' ' HG ' ' A' ' 60' ' ' LEU . 22.0 t70 -112.59 142.68 44.88 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.484 -0.78 . . . . 70.430000000000007 110.024 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -57.66 -48.3 79.87 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 111.752 0.278 . . . . 75.219999999999999 111.752 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -66.86 -41.46 87.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.319999999999993 110.355 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.3 t -62.19 -34.76 77.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.774 -0.648 . . . . 73.329999999999998 110.52 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 56' ' ' ASP . 94.8 mt -77.74 -38.17 47.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.365 -0.379 . . . . 74.129999999999995 110.565 178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.49 -39.93 95.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.846 0.355 . . . . 72.120000000000005 111.251 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.1 p -76.41 5.61 6.93 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.763 0.653 . . . . 64.409999999999997 112.763 -178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -137.55 -49.7 0.6 Allowed 'General case' 0 C--O 1.224 -0.249 0 N-CA-C 112.27 0.47 . . . . 72.209999999999994 112.27 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -97.0 15.96 20.89 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 112.568 0.581 . . . . 73.420000000000002 112.568 -175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 t -110.36 123.82 50.56 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 108.897 -0.779 . . . . 71.439999999999998 108.897 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -85.55 10.74 12.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.073 -0.512 . . . . 52.439999999999998 111.047 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -112.87 -177.66 3.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.969 0.414 . . . . 74.319999999999993 111.468 -178.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.4 t -72.01 -7.74 50.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.726 -0.67 . . . . 71.430000000000007 110.574 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.91 -28.53 67.67 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.936 -0.574 . . . . 72.040000000000006 111.403 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.49 -49.14 78.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.988 -0.551 . . . . 62.299999999999997 111.577 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -81.89 -11.33 58.97 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.131 0.491 . . . . 71.439999999999998 111.292 -178.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.51 1.71 41.29 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.224 -0.444 . . . . 72.019999999999996 110.477 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 60.75 19.31 9.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.807 -0.633 . . . . 73.519999999999996 111.55 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.478 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.59 -36.21 2.64 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.956 -0.565 . . . . 75.530000000000001 113.354 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -61.32 129.77 42.87 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 112.75 0.648 . . . . 75.230000000000004 112.75 -176.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 92.6 mt -107.75 -2.65 19.83 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.431 -0.804 . . . . 64.519999999999996 110.119 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 76.09 -173.09 54.08 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.716 -0.754 . . . . 75.239999999999995 111.28 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.94 107.38 12.68 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 110.208 -0.293 . . . . 74.230000000000004 110.208 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 51.5 p90 -116.58 159.33 22.3 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.436 -0.347 . . . . 63.229999999999997 110.592 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 7.9 t -105.4 171.06 7.53 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.261 -0.427 . . . . 72.329999999999998 110.638 -179.023 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -80.9 148.52 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.921 -0.581 . . . . 72.319999999999993 110.964 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 100.94 34.95 4.42 Favored Glycine 0 N--CA 1.439 -1.122 0 N-CA-C 111.495 -0.642 . . . . 73.140000000000001 111.495 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -141.5 -45.59 0.37 Allowed 'General case' 0 C--O 1.238 0.457 0 N-CA-C 112.173 0.434 . . . . 61.409999999999997 112.173 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -92.68 177.72 6.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.995 0.426 . . . . 65.439999999999998 111.628 -176.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.32 140.67 52.29 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.059 -0.719 . . . . 71.239999999999995 109.059 178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 5.0 mptp? -51.11 -50.42 75.47 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 114.644 1.35 . . . . 75.129999999999995 114.644 -175.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 13.9 Cg_endo -56.97 -25.99 65.64 Favored 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 121.983 1.788 . . . . 73.310000000000002 112.382 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -92.36 -51.33 5.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.273 0.559 . . . . 62.140000000000001 110.07 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 37.5 tt0 -59.32 -53.97 52.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.186 -0.915 . . . . 45.229999999999997 111.564 -177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.02 -41.95 88.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.35 -0.386 . . . . 71.049999999999997 110.753 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.598 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -66.26 -43.59 86.07 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.884 -0.598 . . . . 55.240000000000002 111.319 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.549 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 72.8 p -62.38 -36.27 81.76 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.85 0.357 . . . . 74.25 111.647 -179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.415 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 58.7 m-85 -82.46 -17.83 43.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.483 -0.326 . . . . 70.319999999999993 111.269 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.5 -20.19 44.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.085 0.469 . . . . 52.420000000000002 110.44 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 81.7 mt -78.9 163.53 25.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 75.299999999999997 110.4 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 96' ' ' ARG . 0.6 OUTLIER -106.47 175.42 5.5 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.551 -0.537 . . . . 74.430000000000007 109.551 -179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 92.2 m -64.96 107.94 1.64 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.427 . . . . 71.109999999999999 110.194 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.47 6.91 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.491 -0.644 . . . . 74.510000000000005 111.491 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -123.04 149.25 44.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.69 0.281 . . . . 71.439999999999998 110.887 -177.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.5 ttp -125.06 136.1 53.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.216 -0.447 . . . . 72.140000000000001 110.252 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 48.4 p -77.06 -65.06 1.0 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.116 0.484 . . . . 75.420000000000002 111.681 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 129.51 -142.62 13.78 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 110.936 -0.866 . . . . 70.439999999999998 110.936 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -77.16 99.29 1.29 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.733 2.288 . . . . 75.030000000000001 112.515 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.9 t -104.99 114.04 43.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 120.795 0.331 . . . . 65.120000000000005 110.526 177.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -84.3 148.66 26.54 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.479 -0.328 . . . . 72.200000000000003 110.352 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 20.1 m -153.27 -75.44 0.12 Allowed 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 111.799 0.296 . . . . 73.109999999999999 111.799 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -121.01 80.65 1.67 Allowed 'General case' 0 C--O 1.239 0.547 0 O-C-N 122.399 -0.188 . . . . 72.430000000000007 110.928 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' A' ' 21' ' ' SER . 80.0 p 51.5 27.19 3.66 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.038 0.935 . . . . 63.329999999999998 112.245 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -154.58 156.46 26.89 Favored Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.582 -0.607 . . . . 63.420000000000002 111.582 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.432 ' HB ' HG12 ' A' ' 16' ' ' VAL . 54.2 mt -101.56 131.88 48.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 120.866 0.365 . . . . 74.120000000000005 110.737 -178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -113.31 132.26 55.63 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.807 -0.633 . . . . 72.439999999999998 109.817 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 28.2 mt -106.78 129.79 59.76 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.168 0 N-CA-C 108.013 -1.106 . . . . 74.25 108.013 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 48.1 mt -115.07 121.44 67.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 120.734 0.302 . . . . 72.299999999999997 110.68 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.5 tt -123.32 109.33 13.79 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 108.893 -0.78 . . . . 41.329999999999998 108.893 177.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.481 HH22 ' HG2' ' A' ' 6' ' ' PRO . 68.0 ttt180 -85.45 118.15 24.8 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.274 -0.421 . . . . 73.239999999999995 110.402 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.3 p -88.26 -44.11 11.08 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.202 -0.454 . . . . 70.219999999999999 111.016 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 56.9 mm-40 . . . . . 0 C--O 1.254 1.338 0 CA-C-O 118.9 -0.571 . . . . 71.310000000000002 110.79 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.257 0 N-CA-C 111.833 -0.507 . . . . 51.149999999999999 111.833 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -72.79 106.17 4.65 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 120.741 0.305 . . . . 41.43 110.491 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -78.19 -33.97 49.79 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.337 -0.392 . . . . 51.219999999999999 110.213 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -119.54 143.0 47.84 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.586 . . . . 72.230000000000004 109.75 177.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -67.19 133.67 93.48 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.099 -0.334 . . . . 73.010000000000005 110.099 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -58.22 160.16 16.98 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.664 2.243 . . . . 53.350000000000001 111.493 177.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -51.33 70.47 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 110.804 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -130.99 133.25 45.6 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.377 -0.374 . . . . 74.310000000000002 110.544 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.9 m -118.93 144.33 27.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 109.64 -0.504 . . . . 73.430000000000007 109.64 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.0 ttt180 -107.93 121.59 45.09 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 120.488 -0.485 . . . . 71.530000000000001 110.279 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 92' ' ' SER . 59.9 m -140.54 151.58 44.85 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 115.721 -0.672 . . . . 63.229999999999997 110.317 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 16.2 m -112.02 146.51 37.77 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.794 -0.817 . . . . 62.509999999999998 108.794 176.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.547 ' ND1' HD11 ' A' ' 76' ' ' LEU . 1.6 p-80 -127.51 151.91 48.26 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.484 0.55 . . . . 71.120000000000005 112.484 -177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 8.3 tt -124.05 136.24 54.13 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 107.301 -1.37 . . . . 63.130000000000003 107.301 175.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 111' ' ' HIS . 25.5 tp -128.88 126.88 40.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.516 0.561 . . . . 74.430000000000007 112.516 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.5 t -113.94 125.44 71.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-N 115.455 -0.793 . . . . 51.43 109.525 176.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 34' ' ' ARG . 30.6 mmtm -86.68 154.24 21.14 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.89 -0.595 . . . . 64.540000000000006 110.299 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.482 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -147.84 168.35 22.42 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.182 -0.463 . . . . 64.140000000000001 110.776 179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 35' ' ' THR . 67.1 p -63.49 -20.62 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.189 0.44 . . . . 72.019999999999996 112.189 -175.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 98.3 mt-30 -77.98 -3.76 43.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 65.219999999999999 111.401 -179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 m -91.37 168.03 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.319 -0.622 . . . . 64.430000000000007 109.319 177.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -75.25 -37.22 61.11 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.718 -0.393 . . . . 74.439999999999998 110.521 178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -117.4 87.01 23.4 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.343 -0.39 . . . . 63.109999999999999 111.167 179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -80.33 76.72 4.38 Favored 'Trans proline' 0 N--CA 1.446 -1.313 0 C-N-CA 122.557 2.171 . . . . 74.120000000000005 110.202 176.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -142.48 153.2 43.45 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.767 -0.652 . . . . 71.530000000000001 110.111 -177.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.0 p -145.14 176.02 9.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.848 0.356 . . . . 54.409999999999997 110.054 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 20.5 p-90 -106.85 1.44 24.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.437 0.637 . . . . 74.329999999999998 109.557 176.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -109.24 -24.75 10.95 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.433 -0.803 . . . . 73.319999999999993 110.954 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.74 171.87 12.62 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.239 -0.437 . . . . 75.540000000000006 109.834 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -99.87 -43.6 6.35 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 120.852 0.358 . . . . 72.420000000000002 110.548 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -122.57 133.95 54.54 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.079 -0.51 . . . . 74.430000000000007 111.195 -178.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.6 mm -107.94 97.06 5.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.894 -0.594 . . . . 73.439999999999998 109.658 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -102.87 -0.41 31.27 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.931 -0.577 . . . . 75.25 112.312 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' A' ' 17' ' ' LYS . 7.6 ptp180 -67.29 124.16 22.34 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.693 -0.484 . . . . 63.140000000000001 109.693 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.411 ' HA ' ' OG ' ' A' ' 19' ' ' SER . 29.5 p -86.1 -106.8 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.65 0.611 . . . . 52.140000000000001 112.65 -176.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -93.82 -71.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.138 0.494 . . . . 55.299999999999997 111.357 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -73.42 -24.5 60.27 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.674 -0.693 . . . . 63.030000000000001 110.847 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.08 -23.08 67.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.519 -0.764 . . . . 73.129999999999995 110.917 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -96.99 -29.35 13.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.973 -0.558 . . . . 72.310000000000002 109.843 177.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.4 tp -67.18 -34.58 77.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.463 -0.79 . . . . 63.329999999999998 110.928 -179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 42' ' ' LEU . 10.0 pt-20 -62.38 -31.24 71.87 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.462 -0.335 . . . . 74.319999999999993 111.087 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 41' ' ' GLU . 11.1 mp -68.76 -50.48 50.16 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 109.501 -0.555 . . . . 64.329999999999998 109.501 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 103' ' ' PRO . 37.8 mm -54.91 -53.79 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.251 -0.886 . . . . 72.310000000000002 110.928 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.534 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 94.6 m-20 -60.57 -37.61 81.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.902 -0.59 . . . . 61.030000000000001 110.756 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.53 -42.36 97.64 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 116.087 -0.506 . . . . 65.230000000000004 112.036 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.44 ' O ' HG13 ' A' ' 50' ' ' ILE . 25.3 m-85 -64.86 -45.86 84.27 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.673 -0.491 . . . . 73.030000000000001 109.673 177.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.9 mt -54.21 -33.72 25.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.764 -0.653 . . . . 74.340000000000003 111.286 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 25.9 mm-40 -61.24 -42.54 98.79 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.961 0.41 . . . . 75.129999999999995 110.443 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -81.47 -41.88 21.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.165 -0.471 . . . . 73.540000000000006 111.504 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.517 ' HA ' ' CD ' ' A' ' 55' ' ' GLU . 87.2 mt -56.26 -45.58 81.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 116.358 -0.383 . . . . 74.129999999999995 111.881 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -77.6 -3.98 43.58 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.91 -0.316 . . . . 73.109999999999999 111.716 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.1 m -94.57 -19.94 20.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.974 0.416 . . . . 71.109999999999999 110.417 177.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.82 47.5 54.95 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.036 -0.602 . . . . 41.130000000000003 112.722 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -130.09 8.78 5.2 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.265 0.555 . . . . 73.25 110.657 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.517 ' CD ' ' HA ' ' A' ' 50' ' ' ILE . 0.0 OUTLIER -129.25 -164.8 1.44 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.831 -0.622 . . . . 72.409999999999997 111.415 -177.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -139.86 113.5 8.61 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.593 -0.73 . . . . 75.109999999999999 109.265 175.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -57.32 -37.88 73.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.105 -0.498 . . . . 71.209999999999994 111.382 -176.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 46.2 mt-10 -61.66 -47.03 87.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.666 0.269 . . . . 62.140000000000001 110.981 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.1 t -63.19 -39.62 95.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.345 -0.388 . . . . 71.540000000000006 110.169 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.6 mt -66.56 -43.03 86.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.049 -0.523 . . . . 72.519999999999996 110.86 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.44 -10.09 58.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.144 -0.48 . . . . 51.240000000000002 111.648 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.471 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 26.6 m -102.3 -66.51 0.92 Allowed 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 116.332 -0.394 . . . . 74.129999999999995 111.349 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -82.77 -16.58 47.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.017 0.747 . . . . 75.299999999999997 113.017 -174.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -115.43 22.3 13.33 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.021 0.438 . . . . 64.209999999999994 111.198 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.0 t -123.75 140.18 53.25 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.793 -0.639 . . . . 62.109999999999999 109.428 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -85.19 10.92 10.98 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.916 0.388 . . . . 73.5 110.355 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.495 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -103.9 160.83 14.48 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.112 0.482 . . . . 61.219999999999999 111.995 -176.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 30.8 m -76.44 -5.25 46.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.459 -0.791 . . . . 65.030000000000001 110.491 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.472 ' HB3' ' HA2' ' A' ' 74' ' ' GLY . 31.8 m -54.63 -18.34 4.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.831 -0.622 . . . . 50.420000000000002 112.361 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -50.43 -29.09 9.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 122.833 0.453 . . . . 70.510000000000005 111.54 176.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -59.41 -23.5 62.69 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.278 -0.419 . . . . 74.030000000000001 111.539 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -129.95 18.21 5.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.81 0.338 . . . . 73.030000000000001 110.597 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 0.3 OUTLIER 62.64 16.48 8.9 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.729 -0.669 . . . . 74.409999999999997 112.17 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.472 ' HA2' ' HB3' ' A' ' 69' ' ' SER . . . 86.73 -9.42 71.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.53 -0.843 . . . . 53.530000000000001 113.081 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.534 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 31.5 t70 -81.16 134.32 35.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.897 0.379 . . . . 64.209999999999994 110.752 -179.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.547 HD11 ' ND1' ' A' ' 13' ' ' HIS . 4.5 mp -97.05 -15.15 21.16 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.145 -0.479 . . . . 53.229999999999997 110.652 -178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.49 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.76 -169.0 48.21 Favored Glycine 0 N--CA 1.44 -1.057 0 N-CA-C 110.299 -1.121 . . . . 73.099999999999994 110.299 -175.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -82.19 106.58 14.2 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 117.318 0.559 . . . . 71.439999999999998 109.974 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -121.9 164.71 17.1 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.012 0.434 . . . . 71.409999999999997 111.712 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.8 m -107.98 163.2 13.34 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.723 -0.672 . . . . 72.099999999999994 109.987 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -69.5 153.68 43.15 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.865 0.365 . . . . 71.430000000000007 111.746 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 103.28 26.64 6.86 Favored Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 115.876 -0.602 . . . . 71.099999999999994 111.861 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -128.45 -33.3 2.12 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.119 0.414 . . . . 72.0 112.119 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.1 mmt -119.77 173.96 6.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 74.219999999999999 111.533 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -59.77 137.01 58.17 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.513 . . . . 74.439999999999998 110.214 178.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.461 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 23.7 tptm -47.57 -53.71 28.17 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 113.209 0.818 . . . . 71.109999999999999 113.209 -176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 15.9 Cg_endo -56.97 -26.63 69.09 Favored 'Trans proline' 0 C--N 1.37 1.67 0 C-N-CA 122.553 2.169 . . . . 73.129999999999995 113.176 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -91.83 -46.53 7.82 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.428 0.632 . . . . 73.019999999999996 110.286 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 38.7 tt0 -66.66 -55.07 16.9 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.168 -0.924 . . . . 62.450000000000003 111.795 -176.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -58.3 -33.37 69.38 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.819 0.342 . . . . 61.409999999999997 111.277 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.618 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -60.78 -46.6 89.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.983 -0.553 . . . . 71.120000000000005 111.498 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.469 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 88.8 p -60.84 -40.6 93.45 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 120.956 0.408 . . . . 72.549999999999997 111.725 -177.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -70.75 -22.97 62.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 74.049999999999997 111.338 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -89.57 -6.32 56.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.394 -0.366 . . . . 70.219999999999999 111.497 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 86.9 mt -82.49 174.59 10.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.926 0.393 . . . . 73.5 110.669 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -104.77 152.34 22.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.24 -0.436 . . . . 74.299999999999997 109.991 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 117' ' ' GLU . 85.8 m -64.31 112.34 3.03 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.215 -0.448 . . . . 63.049999999999997 110.726 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.38 15.38 35.34 Favored Glycine 0 N--CA 1.441 -1.024 0 C-N-CA 120.849 -0.691 . . . . 64.109999999999999 112.161 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -125.95 154.75 42.39 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.046 0.45 . . . . 73.329999999999998 110.97 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.486 ' SD ' HG21 ' A' ' 50' ' ' ILE . 55.2 ttp -109.83 152.76 25.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.678 -0.692 . . . . 73.439999999999998 110.291 -178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.432 ' HB3' HD11 ' A' ' 95' ' ' LEU . 88.4 p -93.1 -178.78 4.89 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.015 0.436 . . . . 64.010000000000005 110.544 178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -94.26 -177.4 38.94 Favored Glycine 0 N--CA 1.435 -1.391 0 N-CA-C 110.446 -1.062 . . . . 71.239999999999995 110.446 175.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.453 ' HB3' HG21 ' A' ' 43' ' ' ILE . 17.7 Cg_endo -58.61 111.39 0.86 Allowed 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.651 2.234 . . . . 62.119999999999997 112.041 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.511 ' CG1' ' HB2' ' A' ' 111' ' ' HIS . 11.0 p -100.17 133.21 43.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.676 -0.49 . . . . 74.439999999999998 109.676 178.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -109.59 122.16 46.82 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.028 0.442 . . . . 75.5 111.501 -176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 66.3 p -130.93 -168.91 2.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.992 -0.549 . . . . 73.239999999999995 109.593 177.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -73.18 -10.83 60.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.769 0.285 . . . . 75.129999999999995 111.769 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 23.3 t -99.75 -2.22 35.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 64.109999999999999 111.252 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 121.2 -154.8 16.45 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.329 -0.939 . . . . 71.329999999999998 112.299 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 15.0 mt -98.72 131.43 45.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 109.482 -0.562 . . . . 74.049999999999997 109.482 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.567 ' CE1' HD13 ' A' ' 15' ' ' LEU . 6.3 m-70 -125.34 161.61 26.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.346 0.593 . . . . 75.510000000000005 111.267 -177.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 21.1 mt -127.79 139.16 52.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 107.278 -1.379 . . . . 63.100000000000001 107.278 174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 59.0 mt -124.58 120.59 59.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-O 120.849 0.357 . . . . 62.450000000000003 111.152 -177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.2 tt -113.2 112.41 23.72 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 108.507 -0.923 . . . . 74.209999999999994 108.507 176.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -86.82 114.83 23.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.325 -0.398 . . . . 74.129999999999995 110.697 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.1 p -87.57 -42.66 12.57 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 116.367 -0.379 . . . . 73.439999999999998 110.816 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.434 ' HA ' HG23 ' A' ' 97' ' ' THR . 67.4 mm-40 . . . . . 0 C--O 1.257 1.464 0 CA-C-O 118.737 -0.649 . . . . 52.119999999999997 110.137 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.339 0 N-CA-C 111.718 -0.553 . . . . 62.210000000000001 111.718 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.7 m -79.97 90.08 5.35 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.951 0.405 . . . . 71.450000000000003 110.128 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.1 t-80 -80.33 -37.29 32.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.208 -0.451 . . . . 54.409999999999997 110.575 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 75.2 mtm -79.4 170.6 16.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.365 -0.379 . . . . 72.340000000000003 110.235 178.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HG3' ' HB3' ' A' ' 93' ' ' PHE . 3.6 mp0 59.42 85.47 0.18 Allowed Pre-proline 0 C--O 1.236 0.352 0 O-C-N 123.646 0.591 . . . . 75.129999999999995 110.42 -177.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -57.52 145.03 90.68 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.816 2.344 . . . . 45.520000000000003 112.339 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.468 ' O ' ' HA ' ' A' ' 80' ' ' SER . . . -73.16 -22.59 60.47 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.17 -0.468 . . . . 44.219999999999999 110.648 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.0 mtt180 -130.42 122.36 27.62 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.903 -0.589 . . . . 64.140000000000001 110.753 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.1 m -136.46 169.25 20.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 109.944 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.602 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 53.8 ttt180 -118.88 120.48 37.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.913 0.387 . . . . 54.219999999999999 111.361 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.0 m -137.2 140.55 41.81 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.86 -0.609 . . . . 73.530000000000001 110.175 178.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -96.57 156.37 16.37 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.453 -0.943 . . . . 61.240000000000002 108.453 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.506 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -138.96 139.61 38.0 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.602 0.593 . . . . 72.439999999999998 112.602 -175.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.487 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 5.0 tt -117.97 134.3 55.1 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.057 -1.09 . . . . 75.150000000000006 108.057 177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.417 ' N ' HD23 ' A' ' 14' ' ' LEU . 3.3 mm? -114.63 131.06 56.84 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.84 0.353 . . . . 54.119999999999997 111.689 -177.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.55 103.38 6.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.863 -0.608 . . . . 53.32 110.488 177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -72.45 161.31 30.98 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.862 0.363 . . . . 64.140000000000001 110.168 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.452 ' O ' ' HB2' ' A' ' 21' ' ' SER . 4.2 p80 -131.22 155.64 46.74 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 116.365 -0.38 . . . . 74.019999999999996 110.219 176.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.2 t -36.1 -55.15 0.78 Allowed 'General case' 0 N--CA 1.481 1.086 0 O-C-N 124.202 0.939 . . . . 43.200000000000003 112.457 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.87 87.66 2.28 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.751 -0.833 . . . . 61.520000000000003 108.751 176.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' HIS . 36.1 t -132.78 151.81 51.92 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.823 0.344 . . . . 72.430000000000007 111.236 -176.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -73.16 -22.27 60.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.873 -0.603 . . . . 65.450000000000003 109.572 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -146.98 89.17 5.7 Favored Pre-proline 0 N--CA 1.447 -0.61 0 CA-C-N 115.462 -0.79 . . . . 74.230000000000004 110.001 177.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -73.33 82.64 1.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.59 2.193 . . . . 51.520000000000003 111.291 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -150.72 152.26 33.63 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.161 -0.472 . . . . 54.43 110.493 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 t -147.56 164.64 32.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.194 -0.457 . . . . 70.299999999999997 110.491 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.4 p-90 -80.56 -26.5 37.94 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.387 -0.598 . . . . 71.439999999999998 109.387 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' O ' ' A' ' 63' ' ' GLN . 14.4 ptm180 -100.02 -32.62 10.86 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.434 -0.803 . . . . 73.219999999999999 111.205 -178.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -120.51 142.41 49.33 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.814 0.34 . . . . 71.109999999999999 110.834 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -88.42 -1.66 58.17 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.097 0.475 . . . . 73.239999999999995 110.368 179.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.8 pttt -143.94 148.83 35.91 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.813 -0.631 . . . . 71.230000000000004 110.053 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 49.5 mm -110.35 89.61 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 121.253 0.549 . . . . 74.420000000000002 109.533 176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.2 p -95.18 -13.04 25.34 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.662 -0.699 . . . . 63.340000000000003 111.131 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -66.13 105.18 1.31 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.037 -0.529 . . . . 74.230000000000004 110.144 177.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.4 t -80.77 -177.67 6.44 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.493 -0.321 . . . . 72.109999999999999 110.588 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -55.17 -45.27 75.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.42 -0.355 . . . . 53.200000000000003 111.098 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.53 -42.58 92.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.992 -0.549 . . . . 74.400000000000006 111.272 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 45.6 mm-40 -68.97 -46.97 66.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.929 -0.578 . . . . 64.319999999999993 110.268 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.589 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -61.34 -41.42 97.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.768 -0.651 . . . . 54.43 111.048 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.5 tp -61.24 -39.8 91.67 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.239 -0.437 . . . . 74.120000000000005 110.607 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -71.95 -33.68 68.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.019 -0.537 . . . . 71.019999999999996 110.558 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 88.6 mt -63.09 -45.66 91.02 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.483 -0.562 . . . . 61.539999999999999 109.483 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 39' ' ' ALA . 51.1 mm -57.24 -44.96 84.65 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 115.967 -0.56 . . . . 65.230000000000004 109.683 177.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -54.8 -47.9 73.41 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.476 -0.783 . . . . 74.530000000000001 109.625 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.56 -46.83 92.68 Favored Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.47 -0.787 . . . . 64.030000000000001 112.374 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.436 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 12.7 m-85 -58.87 -48.96 79.56 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.982 -0.377 . . . . 74.430000000000007 109.982 179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 43' ' ' ILE . 77.0 mt -55.39 -48.76 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 115.727 -0.67 . . . . 45.520000000000003 110.573 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -58.9 -45.76 89.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.225 -0.443 . . . . 72.340000000000003 111.278 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -61.63 -48.97 78.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.536 -0.302 . . . . 73.140000000000001 111.364 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.7 mt -68.04 -48.91 72.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 116.164 -0.471 . . . . 74.129999999999995 111.875 -176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -65.71 -29.41 69.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 111.966 0.358 . . . . 74.340000000000003 111.966 -177.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 30.8 t -87.95 -16.76 32.94 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.059 0.457 . . . . 72.299999999999997 110.854 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.28 30.9 43.99 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.591 -0.814 . . . . 65.150000000000006 111.961 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -78.74 -75.32 0.24 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.076 0.465 . . . . 75.409999999999997 110.878 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -104.79 169.19 8.59 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.866 -0.606 . . . . 71.099999999999994 109.694 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -95.98 148.86 22.2 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 110.291 -0.262 . . . . 65.430000000000007 110.291 -179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.6 t80 -60.8 -34.83 75.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 74.299999999999997 109.242 178.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.51 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 48.2 mt-10 -55.74 -50.46 70.32 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.207 -0.906 . . . . 74.209999999999994 110.99 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.0 t -64.07 -37.83 88.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.917 0.389 . . . . 75.150000000000006 110.682 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.97 -42.07 90.39 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.133 -0.485 . . . . 70.209999999999994 110.725 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -77.29 -13.87 59.85 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.069 -0.514 . . . . 54.509999999999998 111.669 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.48 ' HA ' ' CB ' ' A' ' 70' ' ' ALA . 37.3 m -99.89 -0.76 38.95 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.468 -0.333 . . . . 54.140000000000001 111.788 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.405 ' O ' ' HD2' ' A' ' 28' ' ' ARG . 25.4 mt-30 -136.08 -54.59 0.76 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.641 -0.423 . . . . 64.530000000000001 111.857 -178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 79.6 m-85 -77.44 -34.6 54.52 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.669 0.271 . . . . 72.400000000000006 111.353 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 48.5 t -67.34 137.62 56.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.012 -0.54 . . . . 75.299999999999997 110.172 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -90.5 3.98 52.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.16 -0.473 . . . . 73.409999999999997 111.382 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -91.63 160.45 15.38 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.051 0.453 . . . . 73.420000000000002 112.023 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.6 p -70.92 -6.22 36.79 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.55 -0.75 . . . . 73.450000000000003 110.892 179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m -55.68 -19.34 10.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.6 -0.727 . . . . 65.040000000000006 111.559 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.48 ' CB ' ' HA ' ' A' ' 62' ' ' SER . . . -52.85 -29.32 27.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.915 0.486 . . . . 71.530000000000001 111.463 177.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -68.19 -25.6 65.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.984 0.421 . . . . 75.510000000000005 110.956 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -114.02 18.38 17.24 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.147 -0.479 . . . . 53.399999999999999 110.636 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.51 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER 66.48 11.4 8.03 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.747 -0.66 . . . . 54.229999999999997 111.891 179.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.26 -1.65 70.16 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.614 -0.803 . . . . 72.420000000000002 112.827 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.19 144.06 26.02 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.957 0.408 . . . . 73.540000000000006 111.299 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.24 -21.94 13.16 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.942 -0.572 . . . . 63.32 110.486 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 83.48 -155.07 31.97 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.272 -0.966 . . . . 63.149999999999999 111.091 -177.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.52 115.01 19.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.857 0.36 . . . . 54.420000000000002 110.568 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.497 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 53.4 p90 -120.96 167.51 12.49 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.119 -0.492 . . . . 61.240000000000002 109.839 178.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.468 ' HA ' ' O ' ' A' ' 7' ' ' ALA . 3.2 t -114.62 170.48 8.28 Favored 'General case' 0 N--CA 1.438 -1.068 0 C-N-CA 120.946 -0.301 . . . . 71.239999999999995 110.484 -179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 41.2 mtm180 -60.68 -44.91 95.92 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.026 -0.534 . . . . 72.319999999999993 111.508 -177.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -75.32 1.33 56.96 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.771 -0.728 . . . . 55.109999999999999 112.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -115.32 22.0 13.63 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.886 -0.413 . . . . 43.119999999999997 109.886 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.413 ' HG3' ' HB3' ' A' ' 88' ' ' PHE . 40.7 tpp -154.35 163.63 39.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.181 -0.463 . . . . 71.409999999999997 110.673 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -77.36 149.97 35.19 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.786 -0.45 . . . . 74.239999999999995 109.786 177.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.3 tptp -57.89 -50.12 89.87 Favored Pre-proline 0 CA--C 1.552 1.047 0 N-CA-C 113.152 0.797 . . . . 71.140000000000001 113.152 -176.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.455 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 46.9 Cg_exo -58.14 -31.69 93.88 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 121.919 1.746 . . . . 73.299999999999997 112.068 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.458 ' CE2' HG12 ' A' ' 113' ' ' ILE . 5.3 t80 -77.62 -39.41 45.38 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.612 -0.722 . . . . 62.210000000000001 109.178 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -59.03 -59.0 6.17 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.387 -0.824 . . . . 72.120000000000005 110.978 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -56.37 -41.93 77.01 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.813 -0.631 . . . . 75.510000000000005 111.432 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.608 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -62.71 -45.09 94.35 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.005 -0.543 . . . . 75.120000000000005 111.134 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 66.1 m -58.75 -38.72 79.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.849 0.357 . . . . 73.340000000000003 111.769 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.466 ' HB3' ' HG3' ' A' ' 5' ' ' GLU . 19.1 m-85 -78.45 -24.45 46.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.482 -0.326 . . . . 75.340000000000003 111.247 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.71 -23.5 34.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.15 -0.477 . . . . 61.219999999999999 110.261 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.4 mt -80.63 149.8 29.71 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.781 -0.645 . . . . 71.099999999999994 110.356 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.6 169.38 11.76 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 109.1 -0.704 . . . . 70.319999999999993 109.1 176.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.409 HG23 ' HA ' ' A' ' 117' ' ' GLU . 93.3 m -68.2 108.58 3.21 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.302 -0.629 . . . . 64.25 109.302 176.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.19 32.25 6.83 Favored Glycine 0 N--CA 1.44 -1.099 0 N-CA-C 111.32 -0.712 . . . . 31.109999999999999 111.32 -177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.12 149.82 47.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 120.79 0.328 . . . . 70.310000000000002 110.897 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.7 ttp -115.47 142.79 46.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.033 -0.53 . . . . 55.439999999999998 110.915 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' ' 113' ' ' ILE . 46.0 p -81.21 -57.66 3.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.117 0.484 . . . . 54.340000000000003 110.705 178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 128.04 -149.32 18.08 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 110.494 -1.042 . . . . 72.109999999999999 110.494 -177.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -80.97 102.11 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.381 2.054 . . . . 74.340000000000003 112.474 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.9 t -102.18 121.93 53.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 116.185 -0.462 . . . . 64.510000000000005 109.766 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -99.37 111.74 24.05 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 120.856 0.36 . . . . 74.030000000000001 110.972 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 31.9 p -118.72 -18.08 9.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.202 0.525 . . . . 64.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -160.85 -158.64 0.61 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.525 -0.761 . . . . 74.430000000000007 109.499 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.5 m -64.97 -15.04 61.77 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.284 0.476 . . . . 75.120000000000005 112.284 -178.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -109.64 146.52 16.97 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 120.315 -0.945 . . . . 61.130000000000003 112.072 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 53.4 mt -83.63 131.95 32.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 N-CA-C 109.042 -0.725 . . . . 73.420000000000002 109.042 177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -109.2 122.67 47.82 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.431 -0.349 . . . . 71.420000000000002 110.835 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.7 mt -106.76 124.6 62.47 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 N-CA-C 108.687 -0.857 . . . . 72.310000000000002 108.687 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.458 HG12 ' CE2' ' A' ' 88' ' ' PHE . 50.3 mt -105.66 122.23 58.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 116.264 -0.425 . . . . 55.109999999999999 110.927 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.1 tp -124.05 102.7 7.88 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.156 -0.474 . . . . 71.019999999999996 109.812 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -75.18 112.86 11.88 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.917 -0.401 . . . . 75.450000000000003 109.917 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.8 p -89.38 -31.94 17.52 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 116.325 -0.398 . . . . 74.109999999999999 111.396 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.8 mt-10 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.537 -0.744 . . . . 74.230000000000004 110.359 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.33 0 N-CA-C 112.235 -0.346 . . . . 73.340000000000003 112.235 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 105.72 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.961 0.41 . . . . 74.549999999999997 110.74 -179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -139.89 137.53 34.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.254 -0.43 . . . . 45.520000000000003 110.393 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.3 ptt? -145.36 173.8 11.68 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.243 -0.435 . . . . 73.239999999999995 110.34 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -71.71 128.2 89.94 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 109.626 -0.509 . . . . 74.099999999999994 109.626 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.72 153.19 79.25 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 122.146 1.897 . . . . 75.329999999999998 110.915 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -72.46 -29.04 63.31 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.979 0.418 . . . . 64.209999999999994 110.569 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -140.09 131.63 27.07 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.759 -0.655 . . . . 74.400000000000006 109.843 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.5 p -137.18 147.63 26.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.125 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 75.1 ttt180 -104.46 113.39 26.93 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.503 -0.554 . . . . 72.430000000000007 109.503 176.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.8 m -128.13 155.84 43.8 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.204 0.526 . . . . 74.219999999999999 111.504 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -106.1 151.07 25.17 Favored 'General case' 0 C--N 1.309 -1.161 0 N-CA-C 108.459 -0.941 . . . . 73.209999999999994 108.459 176.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.415 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 0.7 OUTLIER -130.96 138.57 49.78 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.881 0.697 . . . . 73.230000000000004 112.881 -175.036 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD23 HD12 ' A' ' 112' ' ' ILE . 34.1 tp -118.92 130.55 55.78 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.073 -1.084 . . . . 73.540000000000006 108.073 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 67' ' ' ALA . 26.7 tp -128.91 120.14 25.64 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.0 0.429 . . . . 75.209999999999994 111.156 -178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.3 t -115.26 131.48 67.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.436 -0.802 . . . . 73.230000000000004 109.709 179.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -81.36 163.44 22.85 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.028 0.442 . . . . 55.43 111.577 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -143.49 161.13 39.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.803 -0.635 . . . . 71.120000000000005 110.01 176.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.5 t -35.83 -61.61 0.47 Allowed 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.462 1.105 . . . . 32.439999999999998 112.841 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -68.85 93.25 0.54 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.063 0.459 . . . . 72.219999999999999 109.844 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.8 t -143.93 144.83 31.89 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.676 -0.693 . . . . 64.299999999999997 110.648 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.08 -6.31 52.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.145 0.498 . . . . 75.420000000000002 110.672 176.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -154.74 100.42 2.38 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.729 -0.669 . . . . 74.349999999999994 109.403 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -89.51 22.45 0.81 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.334 2.689 . . . . 73.129999999999995 112.917 -176.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.9 m -127.82 95.09 4.11 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.062 0.458 . . . . 71.409999999999997 110.495 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.528 ' HB3' ' O ' ' A' ' 66' ' ' ASP . 48.4 m -93.05 -178.29 4.75 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.696 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 16.6 p-90 -65.25 -21.58 66.76 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.375 0.509 . . . . 64.329999999999998 112.375 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -121.65 0.83 9.95 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.773 0.656 . . . . 73.540000000000006 112.773 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.67 165.21 36.66 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.066 -0.654 . . . . 71.120000000000005 112.037 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -146.52 148.8 32.57 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 108.955 -0.758 . . . . 73.219999999999999 108.955 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.3 pttt 45.41 80.35 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.818 0.818 . . . . 75.120000000000005 111.599 -176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mt -65.82 131.67 31.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 114.675 -1.148 . . . . 74.120000000000005 112.408 -176.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 p -99.9 -44.5 6.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.865 -0.607 . . . . 74.109999999999999 110.148 176.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -57.36 110.6 0.89 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.58 -0.736 . . . . 63.119999999999997 111.517 179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.513 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -82.63 -177.99 6.92 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.045 -0.525 . . . . 55.409999999999997 110.497 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -56.84 -43.8 81.48 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.233 0.457 . . . . 73.219999999999999 112.233 -175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.31 -38.54 87.96 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.891 0.376 . . . . 73.200000000000003 111.409 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HG2' HG22 ' A' ' 35' ' ' THR . 5.1 mm-40 -76.34 -30.53 57.68 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.175 -0.466 . . . . 72.340000000000003 110.839 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.68 -24.94 67.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.99 -0.55 . . . . 52.420000000000002 110.761 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.9 mt -61.75 -31.92 72.14 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.011 -0.541 . . . . 74.140000000000001 110.831 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.83 -34.58 78.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.878 0.371 . . . . 75.150000000000006 110.362 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.78 -46.01 39.87 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.318 -0.623 . . . . 63.409999999999997 109.318 176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.518 HG23 HD11 ' A' ' 112' ' ' ILE . 46.5 mm -57.38 -57.21 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 115.538 -0.755 . . . . 70.140000000000001 111.047 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 4.4 m-20 -57.24 -40.46 77.64 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.132 -0.485 . . . . 74.400000000000006 110.523 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.67 -46.05 93.89 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 121.01 -0.614 . . . . 74.129999999999995 111.599 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.403 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.9 m-85 -61.08 -51.9 67.18 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 110.231 -0.285 . . . . 50.310000000000002 110.231 178.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 77.5 mt -52.4 -46.17 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 115.952 -0.567 . . . . 74.230000000000004 111.561 -178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 13.9 mm100 -67.15 -28.91 68.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.41 -0.359 . . . . 73.219999999999999 111.668 -179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -85.64 -33.02 21.7 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.265 0.469 . . . . 74.420000000000002 112.265 -179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 46' ' ' TYR . 76.7 mt -66.55 -38.41 81.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.014 0.435 . . . . 63.340000000000003 110.395 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -72.6 -27.31 62.09 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.927 -0.579 . . . . 73.040000000000006 111.743 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.6 p -86.06 -29.77 23.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.931 0.396 . . . . 70.409999999999997 110.91 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.1 7.09 44.47 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.655 -0.783 . . . . 63.329999999999998 112.203 179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.87 -63.92 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.117 0.484 . . . . 70.120000000000005 110.575 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -105.28 117.43 33.99 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.023 -0.535 . . . . 73.439999999999998 110.108 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -67.57 129.11 38.89 Favored 'General case' 0 CA--C 1.507 -0.677 0 N-CA-C 109.632 -0.507 . . . . 73.439999999999998 109.632 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.402 ' HD1' HD13 ' A' ' 50' ' ' ILE . 55.6 t80 -52.1 -39.46 59.84 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.404 0.44 . . . . 75.340000000000003 111.723 -177.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.45 -53.47 54.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.437 -0.347 . . . . 73.530000000000001 111.014 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.6 t -67.11 -30.5 70.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.16 0.505 . . . . 74.140000000000001 110.325 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.416 HD12 ' CD1' ' A' ' 64' ' ' PHE . 30.7 tp -66.58 -49.65 65.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.541 -0.754 . . . . 74.530000000000001 110.149 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -68.11 -25.19 65.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.069 -0.514 . . . . 72.230000000000004 111.387 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 49.2 m -78.32 -4.77 49.72 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 112.297 0.48 . . . . 73.010000000000005 112.297 -178.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -142.96 -55.38 0.41 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.327 0.491 . . . . 74.129999999999995 112.327 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.416 ' CD1' HD12 ' A' ' 60' ' ' LEU . 91.8 m-85 -78.87 10.36 3.43 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.922 -0.581 . . . . 73.200000000000003 112.51 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' HD12 ' A' ' 14' ' ' LEU . 9.4 t -101.53 132.22 47.28 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.264 -1.013 . . . . 73.140000000000001 108.264 175.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 26' ' ' SER . 45.1 m-20 -79.12 -14.37 59.16 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.936 0.398 . . . . 71.109999999999999 110.854 -178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.479 ' HB2' HD23 ' A' ' 15' ' ' LEU . . . -91.1 -172.55 3.36 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.383 0.512 . . . . 74.040000000000006 112.383 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 23.3 m -70.22 -7.16 39.88 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.753 -0.658 . . . . 72.209999999999994 111.161 -179.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 m -52.9 -34.44 54.91 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.113 0.483 . . . . 65.140000000000001 110.075 178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -54.77 -41.79 70.91 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.139 -0.937 . . . . 75.230000000000004 112.022 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -99.97 13.79 32.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.961 0.41 . . . . 74.530000000000001 110.829 -177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -123.85 4.48 8.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.17 -0.468 . . . . 73.310000000000002 110.764 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 71.17 -5.36 1.57 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.938 0.895 . . . . 74.010000000000005 111.667 179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.415 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 95.4 -21.8 42.38 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.921 -0.656 . . . . 51.439999999999998 112.636 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -75.42 125.75 29.63 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 63.25 111.222 -179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 55.1 mt -89.78 -30.49 17.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.242 -0.436 . . . . 55.509999999999998 110.112 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 97.93 -176.73 31.0 Favored Glycine 0 N--CA 1.434 -1.485 0 N-CA-C 111.017 -0.833 . . . . 70.109999999999999 111.017 -177.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.0 107.82 15.87 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.794 0.331 . . . . 75.310000000000002 110.607 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 39.3 p90 -116.5 156.69 26.45 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.226 -0.443 . . . . 74.439999999999998 110.816 -179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -104.77 158.34 16.58 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.206 -0.452 . . . . 55.439999999999998 109.873 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -60.3 116.79 4.52 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.385 -0.37 . . . . 53.420000000000002 110.674 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 118.44 27.8 2.3 Favored Glycine 0 N--CA 1.44 -1.06 0 C-N-CA 121.145 -0.55 . . . . 73.310000000000002 111.735 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -127.55 -25.82 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.895 0.379 . . . . 64.409999999999997 110.978 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.47 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 51.8 tpp -117.16 164.32 14.96 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.195 -0.457 . . . . 64.329999999999998 110.065 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 85.7 mm-40 -55.33 137.24 48.15 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 109.977 -0.379 . . . . 72.349999999999994 109.977 177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.8 tptm -49.19 -49.84 67.45 Favored Pre-proline 0 CA--C 1.549 0.928 0 N-CA-C 113.825 1.046 . . . . 71.230000000000004 113.825 -175.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.9 Cg_endo -54.63 -32.66 76.12 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 122.299 2.0 . . . . 71.109999999999999 112.342 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.47 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 27.3 t80 -88.2 -43.01 11.93 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.647 -0.501 . . . . 74.319999999999993 109.647 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HD1' ' A' ' 93' ' ' PHE . 2.9 tp10 -56.12 -56.18 24.01 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.313 -0.858 . . . . 74.200000000000003 110.496 -179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -60.04 -36.65 77.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 55.020000000000003 111.518 -178.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.24 -39.8 71.43 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.387 -0.37 . . . . 61.210000000000001 111.401 -179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 40.3 m -62.24 -48.42 80.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.859 0.362 . . . . 71.219999999999999 111.302 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HD1' ' O ' ' A' ' 89' ' ' GLU . 94.0 m-85 -75.2 -5.34 43.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.241 -0.436 . . . . 71.299999999999997 111.824 -178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.35 -9.86 37.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.837 0.351 . . . . 34.140000000000001 110.968 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 95.8 mt -88.03 145.27 26.07 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 116.18 -0.464 . . . . 63.240000000000002 111.457 -178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -75.0 160.12 30.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.521 -0.763 . . . . 64.109999999999999 108.993 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.0 m -60.59 113.67 2.57 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.88 0.372 . . . . 62.310000000000002 110.158 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.44 12.33 61.37 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.803 -0.713 . . . . 73.430000000000007 112.257 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -103.31 148.99 25.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.954 0.407 . . . . 65.010000000000005 110.769 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 55.1 ttp -118.01 149.43 40.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.877 -0.601 . . . . 73.299999999999997 110.25 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 88.3 p -90.46 -172.32 3.39 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.453 -0.339 . . . . 72.549999999999997 110.301 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -104.67 -147.97 17.47 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.469 -1.052 . . . . 63.439999999999998 110.469 175.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.78 92.96 1.01 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.507 2.138 . . . . 54.329999999999998 111.778 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.4 t -83.14 106.91 14.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-O 121.091 0.472 . . . . 64.140000000000001 109.748 179.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.74 144.28 32.3 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.898 -0.592 . . . . 74.140000000000001 110.143 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 23.3 m -144.73 -59.13 0.36 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 121.058 -0.257 . . . . 64.219999999999999 111.426 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -152.8 -106.52 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.741 0.645 . . . . 73.430000000000007 112.741 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 49.4 m -84.85 -0.68 54.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 111.937 0.347 . . . . 74.409999999999997 111.937 -176.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -147.86 156.15 26.8 Favored Glycine 0 N--CA 1.433 -1.55 0 C-N-CA 120.199 -1.0 . . . . 74.310000000000002 112.486 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 56.2 mt -94.83 133.64 35.01 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.72 -0.845 . . . . 74.010000000000005 108.72 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -109.24 136.76 48.18 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.859 0.362 . . . . 74.239999999999995 111.745 -175.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.614 HD12 HD23 ' A' ' 14' ' ' LEU . 18.2 mt -120.11 132.93 68.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 N-CA-C 107.883 -1.155 . . . . 51.229999999999997 107.883 173.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.408 HG12 ' CZ ' ' A' ' 88' ' ' PHE . 25.0 mt -116.79 136.36 54.14 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-O 120.738 0.304 . . . . 63.450000000000003 110.941 -176.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 7.2 tt -130.27 115.09 16.47 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 108.575 -0.898 . . . . 43.149999999999999 108.575 176.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -75.77 121.52 22.68 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.045 0.45 . . . . 74.439999999999998 111.388 -178.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.8 m -89.55 -55.54 3.61 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.804 -0.634 . . . . 74.030000000000001 110.057 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 38.8 mt-10 . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.476 -0.773 . . . . 64.329999999999998 110.388 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.234 0 N-CA-C 111.387 -0.685 . . . . 74.439999999999998 111.387 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 t -80.43 97.34 7.04 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.11 0.481 . . . . 61.399999999999999 109.869 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.407 ' HD2' ' OE2' ' A' ' 5' ' ' GLU . 50.7 t60 -137.49 125.59 22.93 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.87 -0.604 . . . . 75.439999999999998 109.741 -179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.491 ' O ' ' HD3' ' A' ' 6' ' ' PRO . 93.5 mmm -85.36 140.1 31.04 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.296 -0.411 . . . . 72.450000000000003 110.813 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' OE2' ' HD2' ' A' ' 3' ' ' HIS . 35.0 mm-40 -100.71 103.25 23.14 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 116.182 -0.463 . . . . 70.150000000000006 110.347 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.491 ' HD3' ' O ' ' A' ' 4' ' ' MET . 8.8 Cg_exo -73.09 135.46 23.02 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.288 1.992 . . . . 65.120000000000005 111.292 177.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.78 99.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.353 0.597 . . . . 61.130000000000003 109.889 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.8 mtt180 -129.77 134.13 47.41 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.282 -0.872 . . . . 74.439999999999998 109.314 176.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.06 143.66 35.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.277 0 N-CA-C 109.553 -0.536 . . . . 50.200000000000003 109.553 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 67.9 ttt180 -103.55 118.55 36.99 Favored 'General case' 0 N--CA 1.441 -0.891 0 C-N-CA 120.695 -0.402 . . . . 74.510000000000005 110.833 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.7 m -138.22 154.62 49.09 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.965 -0.561 . . . . 73.140000000000001 109.954 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.3 m -95.92 143.94 26.68 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 108.453 -0.943 . . . . 63.039999999999999 108.453 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -130.54 123.23 29.15 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.753 0.649 . . . . 73.030000000000001 112.753 -175.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.01 133.39 52.39 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.837 -1.172 . . . . 73.420000000000002 107.837 176.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -117.53 124.01 47.66 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.886 0.374 . . . . 71.420000000000002 110.934 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.5 t -113.95 126.86 71.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.692 -0.685 . . . . 61.409999999999997 109.992 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -93.28 173.8 7.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.615 0.721 . . . . 73.329999999999998 111.633 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -148.79 157.73 43.65 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.068 -0.969 . . . . 73.109999999999999 108.841 177.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.2 t -59.28 -43.8 92.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.624 0.25 . . . . 75.120000000000005 111.658 -176.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.413 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 16.6 mm-40 -83.65 80.41 9.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.995 0.426 . . . . 65.109999999999999 110.741 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.3 m -138.74 177.83 7.6 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 108.706 -0.849 . . . . 74.219999999999999 108.706 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 50.9 mtp180 -75.06 -46.56 34.03 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.942 -0.762 . . . . 71.329999999999998 108.942 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.69 95.29 35.42 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.744 -0.662 . . . . 64.239999999999995 109.557 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -80.15 40.17 0.93 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.849 2.366 . . . . 54.450000000000003 112.325 -179.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.2 m -95.16 142.73 27.26 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.049 -0.523 . . . . 73.409999999999997 110.613 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.6 p -132.85 155.18 49.46 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.393 -0.367 . . . . 74.409999999999997 110.044 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 14.2 p-90 -91.01 -29.64 17.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.357 0.599 . . . . 74.310000000000002 109.622 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.563 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 1.5 ptm180 -76.71 -15.78 59.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.376 -0.829 . . . . 74.299999999999997 111.55 -177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' GLU . 22.4 tp60 -138.56 -79.13 0.35 Allowed 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.798 -0.445 . . . . 64.140000000000001 109.798 177.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.543 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp10 166.06 -57.88 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.459 0 C-N-CA 123.676 0.791 . . . . 50.130000000000003 109.269 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -130.51 140.83 50.5 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.587 -0.733 . . . . 71.310000000000002 110.178 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.419 ' CG2' ' HG2' ' A' ' 34' ' ' ARG . 49.6 mm -100.5 121.58 51.44 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.106 0 CA-C-N 116.095 -0.502 . . . . 71.219999999999999 110.788 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.1 p -113.85 5.88 16.45 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.123 -0.49 . . . . 73.010000000000005 111.545 -179.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 8.8 ptp85 -75.17 141.4 43.65 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.538 -0.301 . . . . 73.120000000000005 110.563 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -82.02 179.87 7.65 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 120.732 0.301 . . . . 74.409999999999997 110.24 179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -61.43 -38.9 88.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.29 -0.413 . . . . 75.409999999999997 110.519 -179.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 33.1 mt-10 -57.73 -48.49 79.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.762 -0.654 . . . . 73.219999999999999 110.503 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 41.8 mt-10 -63.74 -39.49 94.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.464 -0.789 . . . . 70.109999999999999 111.041 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.46 -43.2 86.19 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 60.229999999999997 110.798 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.15 -41.04 99.2 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.238 -0.437 . . . . 64.019999999999996 111.035 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 33.0 mt-10 -65.05 -36.57 84.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.482 -0.326 . . . . 71.420000000000002 110.87 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 85.5 mt -61.81 -42.23 98.76 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.463 -0.335 . . . . 74.150000000000006 110.112 177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 39' ' ' ALA . 49.9 mm -55.08 -52.37 45.06 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.141 0 CA-C-N 115.919 -0.582 . . . . 60.549999999999997 110.165 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.66 -41.25 94.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.823 -0.626 . . . . 73.150000000000006 110.83 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.67 93.63 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.005 -0.617 . . . . 75.349999999999994 111.777 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -62.13 -51.12 69.15 Favored 'General case' 0 CA--C 1.516 -0.36 0 N-CA-C 110.111 -0.329 . . . . 71.239999999999995 110.111 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -50.0 -44.79 22.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.031 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -60.86 -51.4 69.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.856 -0.611 . . . . 71.140000000000001 111.368 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -66.62 -36.19 81.98 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.381 0.512 . . . . 73.510000000000005 112.381 -177.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 95.9 mt -64.96 -52.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.391 -0.368 . . . . 72.299999999999997 111.763 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -76.43 -21.85 55.41 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.575 0.583 . . . . 72.310000000000002 112.575 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.3 m -83.34 -11.11 58.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.78 0.324 . . . . 63.100000000000001 111.405 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.31 26.72 54.25 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.509 -0.853 . . . . 73.099999999999994 112.552 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -80.09 -54.5 5.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.076 0.465 . . . . 71.519999999999996 109.896 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -122.13 142.95 49.86 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.633 -0.712 . . . . 73.409999999999997 109.925 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -74.41 135.48 42.39 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 108.581 -0.896 . . . . 64.329999999999998 108.581 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -52.01 -46.96 65.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.21 0.319 . . . . 74.340000000000003 110.442 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -56.23 -56.53 19.86 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.988 -0.551 . . . . 64.140000000000001 110.864 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.8 t -63.12 -35.88 81.74 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.084 -0.507 . . . . 24.050000000000001 111.3 -178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.0 tp -66.35 -52.68 44.51 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.188 -0.46 . . . . 71.540000000000006 110.549 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.6 -36.54 80.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.187 -0.46 . . . . 65.439999999999998 111.368 -179.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.561 ' OG ' ' HD2' ' A' ' 73' ' ' ARG . 49.6 m -61.14 -9.22 4.34 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.018 0.747 . . . . 51.399999999999999 113.018 -178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -130.9 -39.11 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.727 0.269 . . . . 73.010000000000005 111.727 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.04 -5.89 57.56 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.252 0.834 . . . . 61.130000000000003 113.252 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.7 m -88.08 124.56 33.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 120.399 -0.52 . . . . 61.100000000000001 109.688 175.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.563 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 16.3 m-20 -73.89 -19.43 60.71 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.034 -0.53 . . . . 72.049999999999997 110.422 -178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.61 -175.5 3.0 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.474 0.546 . . . . 63.450000000000003 112.474 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.5 m -66.43 -6.4 14.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.367 -0.833 . . . . 72.439999999999998 112.267 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.6 m -56.48 -31.8 64.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.188 0.518 . . . . 63.43 110.25 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.409 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -67.81 -35.16 78.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.802 . . . . 73.140000000000001 110.749 178.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -72.11 -18.19 61.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.73 -0.668 . . . . 71.340000000000003 110.581 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.81 5.11 52.4 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.635 -0.711 . . . . 61.030000000000001 109.841 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.561 ' HD2' ' OG ' ' A' ' 62' ' ' SER . 24.2 tpt180 65.01 29.52 12.18 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.289 -0.869 . . . . 72.329999999999998 110.41 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.32 -51.51 4.51 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 121.094 -0.574 . . . . 52.229999999999997 112.783 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -68.31 131.5 45.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.953 0.406 . . . . 71.129999999999995 110.765 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.7 tt -91.57 -24.88 19.45 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.35 -0.611 . . . . 73.430000000000007 109.35 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 86.01 -168.5 41.13 Favored Glycine 0 N--CA 1.437 -1.237 0 C-N-CA 120.455 -0.878 . . . . 44.439999999999998 111.087 -177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.15 107.54 10.81 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.874 0.368 . . . . 73.420000000000002 110.15 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -116.15 149.18 39.45 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.257 -0.429 . . . . 75.209999999999994 110.471 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 39.1 t -86.56 141.71 28.84 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.905 -0.589 . . . . 75.25 109.764 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' HB2' ' OE1' ' A' ' 89' ' ' GLU . 30.1 ptt180 -61.12 -27.25 68.25 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.046 -0.525 . . . . 72.25 111.46 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -74.72 -11.18 83.32 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 71.420000000000002 112.289 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -110.67 14.63 22.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.002 0.43 . . . . 75.519999999999996 110.338 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 39.5 tpp -131.04 153.92 48.77 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.166 -0.47 . . . . 72.010000000000005 111.313 -177.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -63.3 144.96 56.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.897 -0.592 . . . . 64.409999999999997 110.39 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.8 tptm -58.67 -49.28 94.31 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 112.986 0.736 . . . . 74.349999999999994 112.986 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.4 Cg_exo -56.7 -33.29 93.41 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 121.736 1.624 . . . . 74.299999999999997 111.894 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -77.32 -45.39 26.32 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.758 -0.655 . . . . 75.400000000000006 109.595 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.479 ' OE1' ' HB2' ' A' ' 81' ' ' ARG . 24.3 tt0 -57.11 -52.18 66.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.568 -0.742 . . . . 74.310000000000002 110.453 178.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -51.0 -46.19 61.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.125 -0.943 . . . . 64.549999999999997 111.469 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.577 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.09 -43.22 68.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.247 -0.433 . . . . 75.310000000000002 111.273 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 49.3 m -59.47 -40.07 85.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.807 0.337 . . . . 70.340000000000003 111.653 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.462 ' CE2' ' HD2' ' A' ' 6' ' ' PRO . 15.4 m-85 -82.25 -3.36 54.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.297 -0.41 . . . . 74.109999999999999 111.673 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -98.09 -19.53 17.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.096 0.474 . . . . 65.409999999999997 110.033 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 84.8 mt -85.56 152.58 23.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.658 -0.701 . . . . 74.439999999999998 111.126 -178.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.404 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 81.4 mtt180 -108.63 -174.63 2.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.564 -0.744 . . . . 73.129999999999995 109.797 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 18.1 m -61.84 113.01 2.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.795 0.331 . . . . 74.140000000000001 111.006 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.07 25.39 57.76 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.786 -0.721 . . . . 73.430000000000007 112.496 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 96' ' ' ARG . 6.9 tp10 -109.53 147.37 33.06 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.6 0.238 . . . . 74.209999999999994 110.416 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.459 ' HB2' HD13 ' A' ' 114' ' ' LEU . 45.6 ttp -124.13 141.27 52.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.223 -0.444 . . . . 71.019999999999996 110.997 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 64.3 p -89.03 179.88 6.06 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.158 -0.474 . . . . 65.099999999999994 110.721 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.36 -162.12 37.68 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 111.157 -0.777 . . . . 62.119999999999997 111.157 177.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -70.87 108.41 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.371 2.048 . . . . 74.409999999999997 112.755 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.6 t -88.77 104.92 15.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.285 -0.635 . . . . 75.140000000000001 109.285 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -83.17 124.19 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.061 -0.518 . . . . 74.450000000000003 111.855 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 41.5 p -141.55 174.34 10.65 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.15 -0.685 . . . . 54.219999999999999 109.15 176.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.98 -21.34 63.24 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.014 0.435 . . . . 71.430000000000007 110.586 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -81.95 -8.91 59.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.853 -0.612 . . . . 65.120000000000005 110.864 179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 125.64 -164.08 19.35 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 111.616 -0.593 . . . . 65.519999999999996 111.616 -179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.4 mt -99.91 126.8 53.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.676 -0.49 . . . . 75.439999999999998 109.676 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 32.8 m-70 -106.96 134.84 49.5 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.674 0.273 . . . . 72.430000000000007 111.128 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 37.3 mt -109.91 128.53 65.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 107.313 -1.366 . . . . 62.43 107.313 172.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 47.4 mt -117.02 127.73 74.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 120.88 0.372 . . . . 61.420000000000002 111.893 -174.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 100' ' ' MET . 64.9 tp -124.85 107.85 11.32 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.843 -0.799 . . . . 74.340000000000003 108.843 175.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -69.09 126.39 29.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.021 0.439 . . . . 74.200000000000003 111.783 -176.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 9.4 m -98.64 -53.54 3.28 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.591 -0.731 . . . . 73.030000000000001 110.009 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 37.7 mt-10 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.933 -0.556 . . . . 51.43 110.245 -179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.545 0 N-CA-C 112.292 -0.323 . . . . 43.109999999999999 112.292 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 p -145.88 -166.46 2.46 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 109.73 -0.47 . . . . 71.219999999999999 109.73 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -89.63 -48.09 7.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.938 0.399 . . . . 62.25 110.569 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.402 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 26.3 ttt -87.03 -24.34 24.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.062 -0.517 . . . . 64.310000000000002 110.776 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.457 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 12.3 mm-40 72.7 145.75 0.11 Allowed Pre-proline 0 N--CA 1.47 0.548 0 C-N-CA 123.465 0.706 . . . . 73.519999999999996 111.945 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 6.0 Cg_exo -74.76 141.69 27.72 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.478 2.119 . . . . 70.230000000000004 111.859 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.96 -22.3 25.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.283 0.564 . . . . 75.040000000000006 109.774 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -134.62 132.25 38.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.149 -0.932 . . . . 74.019999999999996 109.535 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 78' ' ' ALA . 26.8 m -132.68 146.62 32.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 120.681 0.277 . . . . 62.229999999999997 110.497 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 40.7 ttt180 -104.32 111.2 23.74 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.376 -0.602 . . . . 74.099999999999994 109.376 177.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -124.71 151.31 45.18 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-O 121.244 0.545 . . . . 51.450000000000003 111.345 -178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.7 m -96.8 149.19 22.13 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 108.065 -1.087 . . . . 73.430000000000007 108.065 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.35 139.33 45.56 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.092 0.472 . . . . 73.030000000000001 112.115 -176.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.0 tt -123.46 122.08 37.33 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 108.23 -1.026 . . . . 75.540000000000006 108.23 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.7 tp -119.38 120.5 37.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.296 0.57 . . . . 63.32 111.461 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.04 126.42 61.95 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-N 115.305 -0.861 . . . . 61.119999999999997 108.706 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG2' ' OD1' ' A' ' 66' ' ' ASP . 10.9 ptpp? -103.54 -168.88 1.56 Allowed 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.417 -0.513 . . . . 73.430000000000007 111.482 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.583 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 2.1 p80 -147.44 177.52 9.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.074 -0.512 . . . . 74.310000000000002 110.07 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.3 t -59.57 -37.12 77.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.069 0.461 . . . . 65.219999999999999 110.785 -178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.583 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 21.3 mp0 -79.5 75.34 6.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.151 -0.477 . . . . 63.25 109.838 178.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 69.8 m -154.24 161.45 41.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.616 -0.72 . . . . 73.299999999999997 109.449 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.9 mtp180 -68.72 -34.06 74.99 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 74.319999999999993 111.119 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -136.77 91.21 15.72 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 71.129999999999995 110.267 178.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -77.96 47.29 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 122.949 2.433 . . . . 54.109999999999999 112.284 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.4 p -82.99 156.05 23.64 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.894 -0.593 . . . . 74.099999999999994 111.218 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.423 ' HB2' HD11 ' A' ' 32' ' ' ILE . 30.9 t -149.51 152.12 35.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.155 -0.475 . . . . 73.099999999999994 110.283 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -96.53 -5.66 38.82 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.636 -0.875 . . . . 74.120000000000005 108.636 175.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.5 mtp180 -97.35 -58.49 2.0 Allowed 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.868 -1.06 . . . . 73.319999999999993 110.427 -177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -128.06 -179.19 4.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.048 -0.524 . . . . 74.239999999999995 111.255 -176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -103.97 148.53 26.09 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.751 -0.833 . . . . 74.129999999999995 108.751 176.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.7 pttm 41.07 85.4 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.863 0.865 . . . . 64.25 113.01 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.423 HD11 ' HB2' ' A' ' 26' ' ' SER . 43.9 mt -54.19 111.87 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 63.530000000000001 110.874 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.3 m -105.32 85.23 2.22 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.7 -0.682 . . . . 64.049999999999997 111.039 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 34' ' ' ARG . 8.8 ptp180 -160.38 133.86 6.88 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 108.889 -0.782 . . . . 73.239999999999995 108.889 178.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.404 HG22 ' HG2' ' A' ' 38' ' ' GLU . 14.9 t -83.34 -177.33 6.7 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.83 -0.348 . . . . 54.219999999999999 110.503 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.4 tttm -62.42 -42.24 99.29 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.173 -0.467 . . . . 62.420000000000002 110.454 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -63.02 -43.96 97.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.715 -0.675 . . . . 74.120000000000005 110.921 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.435 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 43.4 mm-40 -59.67 -40.83 89.06 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.259 -0.428 . . . . 74.329999999999998 111.272 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.92 -45.26 90.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.171 -0.468 . . . . 72.430000000000007 110.285 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.0 tp -60.46 -43.57 96.76 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.928 -0.578 . . . . 65.310000000000002 110.596 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -58.27 -39.16 78.49 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.921 -0.581 . . . . 63.200000000000003 110.984 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 97.6 mt -67.82 -46.26 72.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.02 -0.536 . . . . 52.219999999999999 110.236 178.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.2 mm -53.99 -53.84 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-N 116.052 -0.522 . . . . 74.140000000000001 110.958 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.8 m-20 -58.4 -41.4 84.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.995 -0.548 . . . . 72.439999999999998 110.81 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.39 -45.74 95.81 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.838 -0.696 . . . . 51.020000000000003 111.801 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 50' ' ' ILE . 20.4 m-85 -59.38 -50.22 74.79 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.831 0.348 . . . . 73.310000000000002 110.08 178.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 81.5 mt -54.31 -46.38 69.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.69 -0.686 . . . . 73.420000000000002 111.21 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.579 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 31.7 mm-40 -59.57 -43.64 93.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.525 -0.307 . . . . 75.010000000000005 111.242 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -69.87 -39.38 76.36 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.443 -0.344 . . . . 75.310000000000002 111.872 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 46' ' ' TYR . 75.7 mt -69.37 -41.11 80.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 120.758 0.313 . . . . 73.519999999999996 111.289 -179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -66.38 -33.36 75.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 54.100000000000001 111.711 -179.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 6.2 p -80.63 -7.77 59.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.933 0.397 . . . . 74.409999999999997 111.515 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.7 20.69 63.19 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.783 -0.723 . . . . 62.210000000000001 112.298 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -83.82 -72.17 0.47 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.269 0.557 . . . . 73.129999999999995 109.946 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -95.85 148.78 22.24 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.579 -0.737 . . . . 74.430000000000007 110.597 -179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.424 ' O ' HD13 ' A' ' 60' ' ' LEU . 6.0 m-20 -93.64 142.42 27.37 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.239 -0.437 . . . . 73.140000000000001 111.252 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -42.42 89.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.782 -0.644 . . . . 62.439999999999998 110.04 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -61.25 -43.83 98.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.875 -0.602 . . . . 64.299999999999997 111.436 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 24.0 t -62.04 -41.48 98.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.15 0.5 . . . . 63.25 110.401 -179.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' CD2' ' A' ' 64' ' ' PHE . 8.1 mp -73.41 -37.99 65.73 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.953 -0.567 . . . . 75.439999999999998 111.073 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.69 -20.3 61.95 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.848 0.356 . . . . 62.439999999999998 111.248 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.516 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 22.0 m -101.31 10.81 40.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.338 -0.392 . . . . 75.140000000000001 111.542 -179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -142.07 -71.25 0.34 Allowed 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 116.335 -0.393 . . . . 74.219999999999999 111.655 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 95.7 m-85 -62.81 -34.45 77.33 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 111.743 0.275 . . . . 65.340000000000003 111.743 -177.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.6 t -63.38 113.32 3.17 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.774 -0.454 . . . . 64.200000000000003 109.774 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HG2' ' A' ' 17' ' ' LYS . 2.0 p30 -85.83 25.86 1.05 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.185 -0.461 . . . . 64.120000000000005 111.579 -178.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -120.97 -174.85 2.92 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.258 -0.428 . . . . 62.240000000000002 111.162 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 6.1 p -72.37 -5.92 39.73 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 112.215 -178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.7 m -58.89 -33.06 70.07 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.126 0.489 . . . . 72.420000000000002 110.551 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 62' ' ' SER . . . -70.48 -4.96 25.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.692 -0.686 . . . . 74.400000000000006 112.25 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -99.01 5.69 47.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.683 0.278 . . . . 61.310000000000002 111.11 -178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.54 24.86 1.22 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.383 -0.372 . . . . 44.039999999999999 111.313 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 61.5 mtp180 63.29 18.1 10.75 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 116.27 -0.423 . . . . 73.310000000000002 111.535 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 81.93 -0.34 88.58 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.922 -0.656 . . . . 75.530000000000001 112.523 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.62 117.76 18.58 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 110.225 -0.287 . . . . 65.5 110.225 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.496 HD23 ' O ' ' A' ' 76' ' ' LEU . 5.3 tt -89.47 -30.41 18.31 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.149 -0.686 . . . . 61.219999999999999 109.149 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.95 -179.4 30.01 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 112.169 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 9' ' ' VAL . . . -87.02 108.48 18.87 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 110.002 -0.37 . . . . 53.299999999999997 110.002 178.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.36 162.36 17.64 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.328 -0.396 . . . . 72.239999999999995 110.934 -178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.2 t -109.77 170.74 7.87 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.102 -0.499 . . . . 74.230000000000004 109.976 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 66.1 mtm180 -75.93 149.43 37.7 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 53.200000000000003 111.167 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 88.85 18.11 55.06 Favored Glycine 0 N--CA 1.438 -1.228 0 N-CA-C 111.331 -0.708 . . . . 74.140000000000001 111.331 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -124.91 -33.41 2.93 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.884 0.373 . . . . 54.009999999999998 111.381 -178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.8 tpp -103.9 167.59 9.68 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.471 -0.331 . . . . 73.420000000000002 110.125 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -61.08 136.21 58.01 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.33 -0.618 . . . . 74.329999999999998 109.33 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.433 ' HG2' ' OD2' ' A' ' 90' ' ' ASP . 46.1 tttm -50.72 -51.42 66.07 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 113.418 0.896 . . . . 54.5 113.418 -175.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 44.6 Cg_exo -58.5 -22.61 60.24 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.126 1.884 . . . . 75.319999999999993 112.915 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -95.9 -41.77 8.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.191 0.519 . . . . 75.299999999999997 110.149 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 28.9 tt0 -65.15 -46.1 82.25 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.718 -0.674 . . . . 74.209999999999994 111.02 -177.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.433 ' OD2' ' HG2' ' A' ' 86' ' ' LYS . 12.1 m-20 -66.73 -27.26 67.48 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.89 -0.324 . . . . 74.120000000000005 111.018 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.87 -41.46 43.81 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 65.519999999999996 111.082 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 6.4 p -69.85 -43.61 71.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.354 -0.384 . . . . 31.420000000000002 111.524 -179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -74.31 -11.54 60.29 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 111.904 0.335 . . . . 74.5 111.904 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.9 -19.53 37.19 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.182 0.515 . . . . 61.420000000000002 110.065 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -80.35 143.88 33.2 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.62 -0.718 . . . . 73.329999999999998 110.423 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -86.67 166.36 15.4 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 109.082 -0.71 . . . . 73.200000000000003 109.082 176.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.6 m -58.93 114.98 2.82 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.978 0.418 . . . . 71.349999999999994 110.591 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.87 38.92 7.24 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.962 -0.637 . . . . 75.349999999999994 111.802 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -127.45 149.71 49.98 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.741 -0.27 . . . . 63.439999999999998 110.64 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.3 ttp -119.53 137.78 53.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.246 0.546 . . . . 64.040000000000006 111.103 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.419 ' HB2' HD11 ' A' ' 95' ' ' LEU . 13.7 t -92.86 161.18 14.6 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.353 -0.839 . . . . 71.239999999999995 110.585 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.84 -146.6 11.7 Favored Glycine 0 N--CA 1.44 -1.064 0 C-N-CA 120.945 -0.645 . . . . 71.540000000000006 111.669 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.34 103.03 1.45 Allowed 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.617 2.212 . . . . 71.519999999999996 112.894 -178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.0 t -92.75 120.62 42.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.258 -0.428 . . . . 75.549999999999997 110.219 178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -99.32 134.42 42.2 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.292 -0.413 . . . . 75.5 110.695 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 25.0 m -127.5 -60.92 1.16 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.327 -0.397 . . . . 72.549999999999997 110.729 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -151.88 -65.52 0.17 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.084 0.469 . . . . 73.299999999999997 110.351 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 50.8 m -121.06 115.9 23.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.034 -0.53 . . . . 73.420000000000002 110.893 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 90.75 -173.28 38.15 Favored Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.618 -0.801 . . . . 62.32 112.679 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 61.0 mt -121.78 137.03 56.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 109.904 -0.406 . . . . 65.540000000000006 109.904 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -109.98 135.71 50.39 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.205 -0.452 . . . . 72.25 110.173 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 18.9 mt -113.22 140.58 32.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.781 -1.192 . . . . 74.25 107.781 173.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 36.1 mt -125.56 135.26 64.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 C-N-CA 121.144 -0.222 . . . . 64.219999999999999 110.981 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.8 tt -131.78 109.47 10.17 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.626 -0.879 . . . . 73.310000000000002 108.626 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -75.73 110.7 10.36 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 120.878 0.37 . . . . 74.0 110.983 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 4.5 m -78.42 -42.6 29.61 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.737 -0.665 . . . . 63.310000000000002 110.491 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 45.2 mt-10 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.277 -0.868 . . . . 35.299999999999997 110.306 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.089 0 N-CA-C 111.573 -0.611 . . . . 74.299999999999997 111.573 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 t -93.24 142.51 27.23 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 110.246 -0.279 . . . . 73.230000000000004 110.246 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -78.39 -40.31 36.49 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.727 -0.472 . . . . 73.200000000000003 109.727 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 95.5 mmm -79.93 133.44 36.2 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 108.712 -0.847 . . . . 71.329999999999998 108.712 176.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 56.26 69.13 1.92 Allowed Pre-proline 0 CA--C 1.534 0.336 0 O-C-N 123.665 0.603 . . . . 55.140000000000001 109.778 -174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -62.15 142.85 93.46 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.863 2.375 . . . . 74.310000000000002 112.683 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.69 -36.96 36.78 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.623 -0.717 . . . . 51.140000000000001 110.195 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -134.01 139.28 45.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.504 -0.771 . . . . 74.219999999999999 110.103 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.8 m -137.33 160.05 35.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.416 -0.357 . . . . 63.009999999999998 110.135 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 79.8 ttt180 -104.33 118.84 37.61 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.476 -0.564 . . . . 65.530000000000001 109.476 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.2 m -137.56 143.05 41.37 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-O 121.221 0.534 . . . . 71.420000000000002 111.524 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -96.4 147.04 24.23 Favored 'General case' 0 N--CA 1.436 -1.145 0 N-CA-C 108.727 -0.842 . . . . 53.039999999999999 108.727 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.6 OUTLIER -131.17 134.49 46.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.297 0.57 . . . . 64.319999999999993 112.066 -177.573 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.4 tt -115.89 128.7 55.99 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.946 -1.131 . . . . 64.109999999999999 107.946 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 67' ' ' ALA . 3.1 tm? -122.89 116.31 23.41 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.973 0.416 . . . . 71.200000000000003 110.921 -178.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.409 ' CG1' HD11 ' A' ' 43' ' ' ILE . 10.1 p -100.82 138.15 26.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.689 -0.856 . . . . 74.25 108.689 176.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -102.69 164.78 11.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.019 0.438 . . . . 73.219999999999999 111.241 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -129.38 154.01 47.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.09 -0.505 . . . . 72.209999999999994 110.944 -178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.9 t -48.29 -60.72 2.44 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.963 0.905 . . . . 72.510000000000005 112.57 -176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -77.72 84.54 4.05 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.973 0.416 . . . . 71.140000000000001 110.749 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.4 p -137.34 179.0 6.66 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.115 -0.493 . . . . 64.329999999999998 110.434 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 12.5 mtp180 -77.94 -36.75 48.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.163 0.506 . . . . 75.310000000000002 109.771 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 57.9 mmt-85 -130.52 91.54 37.65 Favored Pre-proline 0 C--N 1.318 -0.785 0 CA-C-N 115.659 -0.701 . . . . 72.530000000000001 109.645 177.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.488 ' O ' HG12 ' A' ' 32' ' ' ILE . 13.7 Cg_exo -71.31 -1.66 10.0 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.949 2.433 . . . . 74.549999999999997 113.528 -178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.8 m -86.79 142.25 28.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.846 0.355 . . . . 73.519999999999996 111.013 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.571 ' CB ' ' HB3' ' A' ' 66' ' ' ASP . 90.2 p -139.98 -171.59 3.21 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.133 -0.485 . . . . 75.040000000000006 109.714 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 6.3 p-90 -86.16 -10.21 55.19 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.294 -0.563 . . . . 75.030000000000001 109.73 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -102.89 -40.57 6.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.674 -0.694 . . . . 74.420000000000002 110.751 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.03 161.77 30.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.978 0.418 . . . . 75.310000000000002 110.742 -178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -91.43 -28.02 17.92 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 108.994 -0.743 . . . . 74.209999999999994 108.994 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -149.48 104.42 3.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.095 -0.957 . . . . 61.240000000000002 110.483 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 24' ' ' PRO . 31.4 mm -54.01 132.36 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 115.892 -0.594 . . . . 62.539999999999999 110.666 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.9 m -101.19 -30.83 11.33 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 111.066 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp85 -70.86 135.45 48.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.238 -0.437 . . . . 73.530000000000001 110.686 -178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 38' ' ' GLU . 12.5 t -81.15 178.6 8.3 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 110.199 -0.297 . . . . 33.200000000000003 110.199 178.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -60.68 -39.25 87.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.967 0.413 . . . . 62.439999999999998 110.709 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -63.23 -43.54 97.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.88 -0.6 . . . . 52.32 110.412 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 35' ' ' THR . 32.2 mm-40 -63.13 -39.88 95.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.906 -0.588 . . . . 52.420000000000002 110.297 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -60.1 -43.33 95.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.853 -0.612 . . . . 62.539999999999999 110.247 178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.35 -44.43 95.57 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.084 -0.507 . . . . 70.540000000000006 110.653 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -57.45 -44.91 85.15 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.123 0.487 . . . . 72.400000000000006 110.415 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.65 -39.64 84.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.629 -0.714 . . . . 75.140000000000001 110.861 178.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 39' ' ' ALA . 29.9 mm -56.93 -50.13 76.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.472 -0.331 . . . . 74.209999999999994 110.685 178.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 95.0 m-20 -58.69 -36.99 75.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.489 -0.323 . . . . 71.340000000000003 110.371 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.71 -44.35 98.03 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.876 -0.602 . . . . 53.530000000000001 111.849 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -61.58 -45.75 92.81 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 109.434 -0.58 . . . . 73.519999999999996 109.434 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.92 -45.5 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.559 -0.746 . . . . 73.310000000000002 110.52 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 32.6 mm-40 -56.45 -49.68 73.89 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.306 -0.407 . . . . 71.409999999999997 110.706 179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -62.51 -41.65 98.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.934 -0.576 . . . . 53.439999999999998 111.917 -178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 80.2 mt -68.08 -42.44 85.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.633 0.254 . . . . 73.540000000000006 110.968 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -63.1 -48.14 79.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.459 -0.337 . . . . 73.239999999999995 110.955 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 -32.39 73.02 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.332 -0.395 . . . . 71.109999999999999 111.283 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.17 21.78 9.76 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.673 -0.775 . . . . 54.009999999999998 112.691 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -68.45 -59.28 3.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.036 0.446 . . . . 75.209999999999994 110.461 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -124.52 167.4 14.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.52 -0.764 . . . . 73.420000000000002 110.643 -179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -91.5 162.27 14.62 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.759 -0.655 . . . . 73.5 109.738 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -62.45 -46.63 87.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.533 -0.543 . . . . 71.019999999999996 109.533 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -60.94 -36.21 78.75 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.45 -0.796 . . . . 74.430000000000007 110.951 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 23.5 t -62.79 -40.74 98.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.113 -0.494 . . . . 71.25 110.852 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.0 -33.76 33.46 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.117 -0.492 . . . . 64.310000000000002 110.793 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.62 -50.85 69.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 72.120000000000005 111.212 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.405 ' HA ' ' CA ' ' A' ' 70' ' ' ALA . 55.4 m -71.93 17.57 0.09 Allowed 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.998 0.74 . . . . 71.040000000000006 112.998 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.55 -56.14 0.57 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.873 0.323 . . . . 74.25 111.873 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -89.84 -11.77 41.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 112.854 0.687 . . . . 73.340000000000003 112.854 -173.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 9.4 t -81.79 109.85 16.56 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.446 -0.946 . . . . 65.019999999999996 108.446 176.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.571 ' HB3' ' CB ' ' A' ' 26' ' ' SER . 8.4 m-20 -66.2 -25.36 66.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.826 -0.624 . . . . 71.430000000000007 111.418 -177.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.432 ' HB2' HD12 ' A' ' 15' ' ' LEU . . . -84.21 -178.59 6.99 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 62.420000000000002 111.628 -178.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.8 p -65.32 -7.1 11.89 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.833 -0.621 . . . . 62.039999999999999 112.294 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m -57.15 -32.2 66.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.908 0.385 . . . . 61.149999999999999 110.213 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.405 ' CA ' ' HA ' ' A' ' 62' ' ' SER . . . -60.81 -52.4 65.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.729 -0.669 . . . . 63.130000000000003 111.78 179.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -77.76 -5.57 51.14 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.297 0.57 . . . . 71.420000000000002 111.088 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.5 -0.5 54.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.964 -0.754 . . . . 63.119999999999997 108.964 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 67.68 12.2 8.74 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 114.895 -1.048 . . . . 73.120000000000005 110.762 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.426 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 82.39 -39.11 2.63 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.958 -0.564 . . . . 51.130000000000003 112.978 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -70.58 124.35 24.02 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.205 0.446 . . . . 61.219999999999999 112.205 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 71.0 mt -95.55 -13.82 24.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.76 -0.654 . . . . 74.430000000000007 110.331 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 82.95 -165.51 43.71 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.503 -0.856 . . . . 64.049999999999997 110.964 -176.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.23 112.96 19.04 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 110.028 -0.36 . . . . 73.439999999999998 110.028 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 44.8 p90 -120.21 161.05 21.74 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.329 -0.396 . . . . 74.540000000000006 111.384 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.1 t -99.18 167.23 10.82 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.642 -0.708 . . . . 71.340000000000003 110.596 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -73.52 118.6 16.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.067 -0.515 . . . . 75.450000000000003 110.228 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 120.78 28.2 1.77 Allowed Glycine 0 N--CA 1.443 -0.856 0 C-N-CA 120.649 -0.786 . . . . 72.510000000000005 112.018 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -110.4 -25.38 10.1 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.579 0.228 . . . . 72.140000000000001 111.1 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.485 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 32.6 tpp -130.61 -178.72 4.9 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 110.221 -0.288 . . . . 73.010000000000005 110.221 -178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.485 ' H ' ' HG3' ' A' ' 84' ' ' MET . 15.7 mm100 -63.2 151.83 39.24 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.078 -0.342 . . . . 74.510000000000005 110.078 178.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.8 tptm -57.05 -47.04 99.74 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.254 0.835 . . . . 71.239999999999995 113.254 -176.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_exo -55.37 -23.07 36.4 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 122.101 1.867 . . . . 75.0 112.334 178.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -88.79 -49.53 6.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.01 -0.541 . . . . 74.409999999999997 109.603 178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.89 -32.28 71.75 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.555 -0.748 . . . . 73.209999999999994 111.089 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.26 -28.94 67.65 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.735 -0.666 . . . . 74.319999999999993 110.969 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -87.77 -42.41 12.62 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.194 -0.457 . . . . 64.120000000000005 111.493 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 11.0 p -59.87 -45.64 91.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.004 0.431 . . . . 53.100000000000001 111.707 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -87.38 14.23 8.41 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.278 -0.419 . . . . 55.100000000000001 112.041 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -115.0 -0.02 13.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.169 0.509 . . . . 55.450000000000003 110.29 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 97.8 mt -94.7 151.26 19.42 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.684 -0.689 . . . . 63.219999999999999 110.809 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mtp180 -97.09 177.36 5.62 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.906 -0.588 . . . . 74.519999999999996 109.808 178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.6 m -62.29 117.98 6.83 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.865 0.364 . . . . 74.329999999999998 111.232 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.45 28.16 58.14 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 121.112 -0.566 . . . . 74.349999999999994 111.816 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -115.01 143.36 45.31 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 120.864 0.364 . . . . 72.430000000000007 110.732 -178.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -119.16 143.93 46.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.87 -0.604 . . . . 64.150000000000006 109.837 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 89.9 p -85.77 175.33 8.75 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 120.96 0.41 . . . . 75.019999999999996 110.476 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.49 -162.89 38.63 Favored Glycine 0 N--CA 1.433 -1.52 0 N-CA-C 110.637 -0.985 . . . . 75.439999999999998 110.637 175.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -68.79 115.91 4.18 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.244 1.963 . . . . 74.129999999999995 112.311 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -92.29 108.52 20.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 109.098 -0.704 . . . . 72.439999999999998 109.098 176.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -84.3 123.69 30.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.199 -0.455 . . . . 75.310000000000002 112.078 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.1 p -137.48 -177.44 4.79 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.646 -0.706 . . . . 61.520000000000003 109.552 177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -77.79 -35.19 51.75 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.895 0.378 . . . . 74.140000000000001 111.032 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.0 m -71.6 -31.91 67.43 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.167 0.508 . . . . 74.239999999999995 110.708 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 162.64 -147.87 14.26 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 111.542 -0.623 . . . . 54.229999999999997 111.542 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 64.9 mt -117.86 132.34 67.97 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.959 0 N-CA-C 109.79 -0.448 . . . . 75.140000000000001 109.79 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -109.36 143.59 38.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.362 -0.381 . . . . 75.150000000000006 110.684 -177.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 18.5 mt -118.88 137.23 53.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 107.775 -1.195 . . . . 55.020000000000003 107.775 173.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 53.8 mt -127.06 137.07 58.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 120.429 0.157 . . . . 74.25 110.677 -177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.7 tt -135.61 119.29 17.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.532 -0.544 . . . . 72.140000000000001 109.532 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -87.6 116.53 25.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.769 0.318 . . . . 73.519999999999996 110.857 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 10.1 p -93.26 -35.84 12.89 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 116.207 -0.451 . . . . 70.019999999999996 110.638 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 53.1 mt-10 . . . . . 0 C--O 1.238 0.483 0 CA-C-O 118.493 -0.765 . . . . 41.229999999999997 110.178 -179.638 . . . . . . . . 1 1 . 1 stop_ save_